[(1R,2S,5R)-5-methyl-2-propan-2-yl-cyclohexyl] 2-(5-methoxy-2-nitro-phenyl)prop-2-enoate

Systemtic Name: [(1R,2S,5R)-5-methyl-2-propan-2-yl-cyclohexyl] 2-(5-methoxy-2-nitro-phenyl)prop-2-enoate Openeye Name: [(1R,2S,5R)-2-isopropyl-5-methyl-cyclohexyl] 2-(5-methoxy-2-nitro-phenyl)prop-2-enoate CAS Name: 2-(5-methoxy-2-nitrophenyl)-2-propenoic acid [(1R,2S,5R)-5-methyl-2-propan-2-ylcyclohexyl] ester IUPAC Name: [(1R,2S,5R)-5-methyl-2-propan-2-ylcyclohexyl] 2-(5-methoxy-2-nitrophenyl)prop-2-enoate Traditional Name: 2-(5-methoxy-2-nitro-phenyl)acrylic acid [(1R,2S,5R)-2-isopropyl-5-methyl-cyclohexyl] ester Formula: C20H27NO5 MolecularWeight: 361.43208

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Descriptors Computed from Structure

Canonical SMILES:

CC1CCC(C(C1)OC(=O)C(=C)C2=C(C=CC(=C2)OC)[N+](=O)[O-])C(C)C

Isomeric SMILES

C[C@@H]1CC[C@H]([C@@H](C1)OC(=O)C(=C)C2=C(C=CC(=C2)OC)[N+](=O)[O-])C(C)C

InChI

InChI=1S/C20H27NO5/c1-12(2)16-8-6-13(3)10-19(16)26-20(22)14(4)17-11-15(25-5)7-9-18(17)21(23)24/h7,9,11-13,16,19H,4,6,8,10H2,1-3,5H3/t13-,16+,19-/m1/s1