methyl 4-[2-(7-ethyl-1H-indol-3-yl)-2-oxidanylidene-ethoxy]-3-nitro-benzoate

Systemtic Name: methyl 4-[2-(7-ethyl-1H-indol-3-yl)-2-oxidanylidene-ethoxy]-3-nitro-benzoate Openeye Name: methyl 4-[2-(7-ethyl-1H-indol-3-yl)-2-oxo-ethoxy]-3-nitro-benzoate CAS Name: 4-[2-(7-ethyl-1H-indol-3-yl)-2-oxoethoxy]-3-nitrobenzoic acid methyl ester IUPAC Name: methyl 4-[2-(7-ethyl-1H-indol-3-yl)-2-oxoethoxy]-3-nitrobenzoate Traditional Name: 4-[2-(7-ethyl-1H-indol-3-yl)-2-keto-ethoxy]-3-nitro-benzoic acid methyl ester Formula: C20H18N2O6 MolecularWeight: 382.36672

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=CC=CC2=C1NC=C2C(=O)COC3=C(C=C(C=C3)C(=O)OC)[N+](=O)[O-]

Isomeric SMILES

CCC1=CC=CC2=C1NC=C2C(=O)COC3=C(C=C(C=C3)C(=O)OC)[N+](=O)[O-]

InChI

InChI=1S/C20H18N2O6/c1-3-12-5-4-6-14-15(10-21-19(12)14)17(23)11-28-18-8-7-13(20(24)27-2)9-16(18)22(25)26/h4-10,21H,3,11H2,1-2H3