(phenylmethyl) 6-[1-(3-nitrophenyl)carbonylindol-3-yl]hexanoate

Systemtic Name: (phenylmethyl) 6-[1-(3-nitrophenyl)carbonylindol-3-yl]hexanoate Openeye Name: benzyl 6-[1-(3-nitrobenzoyl)indol-3-yl]hexanoate CAS Name: 6-[1-[(3-nitrophenyl)-oxomethyl]-3-indolyl]hexanoic acid (phenylmethyl) ester IUPAC Name: benzyl 6-[1-(3-nitrobenzoyl)indol-3-yl]hexanoate Traditional Name: 6-[1-(3-nitrobenzoyl)indol-3-yl]hexanoic acid benzyl ester Formula: C28H26N2O5 MolecularWeight: 470.51644

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)COC(=O)CCCCCC2=CN(C3=CC=CC=C32)C(=O)C4=CC(=CC=C4)[N+](=O)[O-]

Isomeric SMILES

C1=CC=C(C=C1)COC(=O)CCCCCC2=CN(C3=CC=CC=C32)C(=O)C4=CC(=CC=C4)[N+](=O)[O-]

InChI

InChI=1S/C28H26N2O5/c31-27(35-20-21-10-3-1-4-11-21)17-6-2-5-12-23-19-29(26-16-8-7-15-25(23)26)28(32)22-13-9-14-24(18-22)30(33)34/h1,3-4,7-11,13-16,18-19H,2,5-6,12,17,20H2