4-[1-[(3-aminophenyl)methyl]indol-3-yl]butanoic acid

Systemtic Name: 4-[1-[(3-aminophenyl)methyl]indol-3-yl]butanoic acid Openeye Name: 4-[1-[(3-aminophenyl)methyl]indol-3-yl]butanoic acid CAS Name: 4-[1-[(3-aminophenyl)methyl]-3-indolyl]butanoic acid IUPAC Name: 4-[1-[(3-aminophenyl)methyl]indol-3-yl]butanoic acid Traditional Name: 4-[1-(3-aminobenzyl)indol-3-yl]butyric acid Formula: C19H20N2O2 MolecularWeight: 308.3743

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)C(=CN2CC3=CC(=CC=C3)N)CCCC(=O)O

Isomeric SMILES

C1=CC=C2C(=C1)C(=CN2CC3=CC(=CC=C3)N)CCCC(=O)O

InChI

InChI=1S/C19H20N2O2/c20-16-7-3-5-14(11-16)12-21-13-15(6-4-10-19(22)23)17-8-1-2-9-18(17)21/h1-3,5,7-9,11,13H,4,6,10,12,20H2,(H,22,23)