5-[1-(3-aminophenyl)carbonylindol-3-yl]pentanoic acid

Systemtic Name: 5-[1-(3-aminophenyl)carbonylindol-3-yl]pentanoic acid Openeye Name: 5-[1-(3-aminobenzoyl)indol-3-yl]pentanoic acid CAS Name: 5-[1-[(3-aminophenyl)-oxomethyl]-3-indolyl]pentanoic acid IUPAC Name: 5-[1-(3-aminobenzoyl)indol-3-yl]pentanoic acid Traditional Name: 5-[1-(3-aminobenzoyl)indol-3-yl]valeric acid Formula: C20H20N2O3 MolecularWeight: 336.3844

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)C(=CN2C(=O)C3=CC(=CC=C3)N)CCCCC(=O)O

Isomeric SMILES

C1=CC=C2C(=C1)C(=CN2C(=O)C3=CC(=CC=C3)N)CCCCC(=O)O

InChI

InChI=1S/C20H20N2O3/c21-16-8-5-7-14(12-16)20(25)22-13-15(6-1-4-11-19(23)24)17-9-2-3-10-18(17)22/h2-3,5,7-10,12-13H,1,4,6,11,21H2,(H,23,24)