2-azanyl-4-methoxy-3-[4-(phenylmethyl)-1H-indol-3-yl]butanoic acid

Systemtic Name: 2-azanyl-4-methoxy-3-[4-(phenylmethyl)-1H-indol-3-yl]butanoic acid Openeye Name: 2-amino-3-(4-benzyl-1H-indol-3-yl)-4-methoxy-butanoic acid CAS Name: 2-amino-4-methoxy-3-[4-(phenylmethyl)-1H-indol-3-yl]butanoic acid IUPAC Name: 2-amino-3-(4-benzyl-1H-indol-3-yl)-4-methoxybutanoic acid Traditional Name: 2-amino-3-(4-benzyl-1H-indol-3-yl)-4-methoxy-butyric acid Formula: C20H22N2O3 MolecularWeight: 338.40028

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COCC(C1=CNC2=CC=CC(=C21)CC3=CC=CC=C3)C(C(=O)O)N

Isomeric SMILES

COCC(C1=CNC2=CC=CC(=C21)CC3=CC=CC=C3)C(C(=O)O)N

InChI

InChI=1S/C20H22N2O3/c1-25-12-16(19(21)20(23)24)15-11-22-17-9-5-8-14(18(15)17)10-13-6-3-2-4-7-13/h2-9,11,16,19,22H,10,12,21H2,1H3,(H,23,24)