(phenylmethyl) 3-[1-(3-nitrophenyl)carbonylindol-3-yl]propanoate

Systemtic Name: (phenylmethyl) 3-[1-(3-nitrophenyl)carbonylindol-3-yl]propanoate Openeye Name: benzyl 3-[1-(3-nitrobenzoyl)indol-3-yl]propanoate CAS Name: 3-[1-[(3-nitrophenyl)-oxomethyl]-3-indolyl]propanoic acid (phenylmethyl) ester IUPAC Name: benzyl 3-[1-(3-nitrobenzoyl)indol-3-yl]propanoate Traditional Name: 3-[1-(3-nitrobenzoyl)indol-3-yl]propionic acid benzyl ester Formula: C25H20N2O5 MolecularWeight: 428.4367

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)COC(=O)CCC2=CN(C3=CC=CC=C32)C(=O)C4=CC(=CC=C4)[N+](=O)[O-]

Isomeric SMILES

C1=CC=C(C=C1)COC(=O)CCC2=CN(C3=CC=CC=C32)C(=O)C4=CC(=CC=C4)[N+](=O)[O-]

InChI

InChI=1S/C25H20N2O5/c28-24(32-17-18-7-2-1-3-8-18)14-13-20-16-26(23-12-5-4-11-22(20)23)25(29)19-9-6-10-21(15-19)27(30)31/h1-12,15-16H,13-14,17H2