[(3R,6R,7S,8S)-7-methoxy-8-[(2S,3S)-2-methyl-3-(3-methylbut-2-enyl)oxiran-2-yl]-2-oxaspiro[2.5]octan-6-yl] (E)-3-[3-nitro-4-(5-oxidanylpentoxy)phenyl]prop-2-enoate

Systemtic Name: [(3R,6R,7S,8S)-7-methoxy-8-[(2S,3S)-2-methyl-3-(3-methylbut-2-enyl)oxiran-2-yl]-2-oxaspiro[2.5]octan-6-yl] (E)-3-[3-nitro-4-(5-oxidanylpentoxy)phenyl]prop-2-enoate Openeye Name: [(3R,6R,7S,8S)-7-methoxy-8-[(2S,3S)-2-methyl-3-(3-methylbut-2-enyl)oxiran-2-yl]-2-oxaspiro[2.5]octan-6-yl] (E)-3-[4-(5-hydroxypentoxy)-3-nitro-phenyl]prop-2-enoate CAS Name: (E)-3-[4-(5-hydroxypentoxy)-3-nitrophenyl]-2-propenoic acid [(3R,6R,7S,8S)-7-methoxy-8-[(2S,3S)-2-methyl-3-(3-methylbut-2-enyl)-2-oxiranyl]-2-oxaspiro[2.5]octan-6-yl] ester IUPAC Name: [(3R,6R,7S,8S)-7-methoxy-8-[(2S,3S)-2-methyl-3-(3-methylbut-2-enyl)oxiran-2-yl]-2-oxaspiro[2.5]octan-6-yl] (E)-3-[4-(5-hydroxypentoxy)-3-nitrophenyl]prop-2-enoate Traditional Name: (E)-3-[4-(5-hydroxypentoxy)-3-nitro-phenyl]acrylic acid [(3R,6R,7S,8S)-7-methoxy-8-[(2S,3S)-2-methyl-3-(3-methylbut-2-enyl)oxiran-2-yl]-2-oxaspiro[2.5]octan-6-yl] ester Formula: C30H41NO9 MolecularWeight: 559.64784

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Descriptors Computed from Structure

Canonical SMILES:

CC(=CCC1C(O1)(C)C2C(C(CCC23CO3)OC(=O)C=CC4=CC(=C(C=C4)OCCCCCO)[N+](=O)[O-])OC)C

Isomeric SMILES

CC(=CC[C@H]1[C@](O1)(C)[C@H]2[C@@H]([C@@H](CC[C@]23CO3)OC(=O)/C=C/C4=CC(=C(C=C4)OCCCCCO)[N+](=O)[O-])OC)C

InChI

InChI=1S/C30H41NO9/c1-20(2)8-12-25-29(3,40-25)28-27(36-4)24(14-15-30(28)19-38-30)39-26(33)13-10-21-9-11-23(22(18-21)31(34)35)37-17-7-5-6-16-32/h8-11,13,18,24-25,27-28,32H,5-7,12,14-17,19H2,1-4H3/b13-10+/t24-,25+,27-,28-,29-,30+/m1/s1