ethyl 4-[3-(3-nitrophenyl)carbonylindol-1-yl]butanoate

Systemtic Name: ethyl 4-[3-(3-nitrophenyl)carbonylindol-1-yl]butanoate Openeye Name: ethyl 4-[3-(3-nitrobenzoyl)indol-1-yl]butanoate CAS Name: 4-[3-[(3-nitrophenyl)-oxomethyl]-1-indolyl]butanoic acid ethyl ester IUPAC Name: ethyl 4-[3-(3-nitrobenzoyl)indol-1-yl]butanoate Traditional Name: 4-[3-(3-nitrobenzoyl)indol-1-yl]butyric acid ethyl ester Formula: C21H20N2O5 MolecularWeight: 380.3939

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)CCCN1C=C(C2=CC=CC=C21)C(=O)C3=CC(=CC=C3)[N+](=O)[O-]

Isomeric SMILES

CCOC(=O)CCCN1C=C(C2=CC=CC=C21)C(=O)C3=CC(=CC=C3)[N+](=O)[O-]

InChI

InChI=1S/C21H20N2O5/c1-2-28-20(24)11-6-12-22-14-18(17-9-3-4-10-19(17)22)21(25)15-7-5-8-16(13-15)23(26)27/h3-5,7-10,13-14H,2,6,11-12H2,1H3