methyl 4-[2-nitro-1-(6,6,9,9-tetramethyl-4-oxidanylidene-2,3,7,8-tetrahydrobenzo[g]chromen-3-yl)ethyl]benzoate

Systemtic Name: methyl 4-[2-nitro-1-(6,6,9,9-tetramethyl-4-oxidanylidene-2,3,7,8-tetrahydrobenzo[g]chromen-3-yl)ethyl]benzoate Openeye Name: methyl 4-[2-nitro-1-(6,6,9,9-tetramethyl-4-oxo-2,3,7,8-tetrahydrobenzo[g]chromen-3-yl)ethyl]benzoate CAS Name: 4-[2-nitro-1-(6,6,9,9-tetramethyl-4-oxo-2,3,7,8-tetrahydrobenzo[g][1]benzopyran-3-yl)ethyl]benzoic acid methyl ester IUPAC Name: methyl 4-[2-nitro-1-(6,6,9,9-tetramethyl-4-oxo-2,3,7,8-tetrahydrobenzo[g]chromen-3-yl)ethyl]benzoate Traditional Name: 4-[1-(4-keto-6,6,9,9-tetramethyl-2,3,7,8-tetrahydrobenzo[g]chromen-3-yl)-2-nitro-ethyl]benzoic acid methyl ester Formula: C27H31NO6 MolecularWeight: 465.53814

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Descriptors Computed from Structure

Canonical SMILES:

CC1(CCC(C2=C1C=C3C(=C2)OCC(C3=O)C(C[N+](=O)[O-])C4=CC=C(C=C4)C(=O)OC)(C)C)C

Isomeric SMILES

CC1(CCC(C2=C1C=C3C(=C2)OCC(C3=O)C(C[N+](=O)[O-])C4=CC=C(C=C4)C(=O)OC)(C)C)C

InChI

InChI=1S/C27H31NO6/c1-26(2)10-11-27(3,4)22-13-23-18(12-21(22)26)24(29)20(15-34-23)19(14-28(31)32)16-6-8-17(9-7-16)25(30)33-5/h6-9,12-13,19-20H,10-11,14-15H2,1-5H3