4-[3-(4-nitrophenyl)carbonylindol-1-yl]butanoic acid

Systemtic Name: 4-[3-(4-nitrophenyl)carbonylindol-1-yl]butanoic acid Openeye Name: 4-[3-(4-nitrobenzoyl)indol-1-yl]butanoic acid CAS Name: 4-[3-[(4-nitrophenyl)-oxomethyl]-1-indolyl]butanoic acid IUPAC Name: 4-[3-(4-nitrobenzoyl)indol-1-yl]butanoic acid Traditional Name: 4-[3-(4-nitrobenzoyl)indol-1-yl]butyric acid Formula: C19H16N2O5 MolecularWeight: 352.34074

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)C(=CN2CCCC(=O)O)C(=O)C3=CC=C(C=C3)[N+](=O)[O-]

Isomeric SMILES

C1=CC=C2C(=C1)C(=CN2CCCC(=O)O)C(=O)C3=CC=C(C=C3)[N+](=O)[O-]

InChI

InChI=1S/C19H16N2O5/c22-18(23)6-3-11-20-12-16(15-4-1-2-5-17(15)20)19(24)13-7-9-14(10-8-13)21(25)26/h1-2,4-5,7-10,12H,3,6,11H2,(H,22,23)