4-[1-(5-azanyl-2,3-dimethyl-phenyl)carbonylindol-3-yl]butanoic acid

Systemtic Name: 4-[1-(5-azanyl-2,3-dimethyl-phenyl)carbonylindol-3-yl]butanoic acid Openeye Name: 4-[1-(5-amino-2,3-dimethyl-benzoyl)indol-3-yl]butanoic acid CAS Name: 4-[1-[(5-amino-2,3-dimethylphenyl)-oxomethyl]-3-indolyl]butanoic acid IUPAC Name: 4-[1-(5-amino-2,3-dimethylbenzoyl)indol-3-yl]butanoic acid Traditional Name: 4-[1-(5-amino-2,3-dimethyl-benzoyl)indol-3-yl]butyric acid Formula: C21H22N2O3 MolecularWeight: 350.41098

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=CC(=C1)N)C(=O)N2C=C(C3=CC=CC=C32)CCCC(=O)O)C

Isomeric SMILES

CC1=C(C(=CC(=C1)N)C(=O)N2C=C(C3=CC=CC=C32)CCCC(=O)O)C

InChI

InChI=1S/C21H22N2O3/c1-13-10-16(22)11-18(14(13)2)21(26)23-12-15(6-5-9-20(24)25)17-7-3-4-8-19(17)23/h3-4,7-8,10-12H,5-6,9,22H2,1-2H3,(H,24,25)