methyl 3-methoxy-4-[[1-(naphthalen-2-ylmethyl)-5-nitro-indol-3-yl]methyl]benzoate

Systemtic Name: methyl 3-methoxy-4-[[1-(naphthalen-2-ylmethyl)-5-nitro-indol-3-yl]methyl]benzoate Openeye Name: methyl 3-methoxy-4-[[1-(2-naphthylmethyl)-5-nitro-indol-3-yl]methyl]benzoate CAS Name: 3-methoxy-4-[[1-(2-naphthalenylmethyl)-5-nitro-3-indolyl]methyl]benzoic acid methyl ester IUPAC Name: methyl 3-methoxy-4-[[1-(naphthalen-2-ylmethyl)-5-nitroindol-3-yl]methyl]benzoate Traditional Name: 3-methoxy-4-[[1-(2-naphthylmethyl)-5-nitro-indol-3-yl]methyl]benzoic acid methyl ester Formula: C29H24N2O5 MolecularWeight: 480.51126

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=CC(=C1)C(=O)OC)CC2=CN(C3=C2C=C(C=C3)[N+](=O)[O-])CC4=CC5=CC=CC=C5C=C4

Isomeric SMILES

COC1=C(C=CC(=C1)C(=O)OC)CC2=CN(C3=C2C=C(C=C3)[N+](=O)[O-])CC4=CC5=CC=CC=C5C=C4

InChI

InChI=1S/C29H24N2O5/c1-35-28-15-23(29(32)36-2)10-9-22(28)14-24-18-30(27-12-11-25(31(33)34)16-26(24)27)17-19-7-8-20-5-3-4-6-21(20)13-19/h3-13,15-16,18H,14,17H2,1-2H3