(2R)-3-(1H-indol-3-yl)-2-[(phenylmethyl)azaniumyl]propanoate

Systemtic Name: (2R)-3-(1H-indol-3-yl)-2-[(phenylmethyl)azaniumyl]propanoate Openeye Name: (2R)-2-(benzylammonio)-3-(1H-indol-3-yl)propanoate CAS Name: (2R)-3-(1H-indol-3-yl)-2-[(phenylmethyl)ammonio]propanoate IUPAC Name: (2R)-2-(benzylazaniumyl)-3-(1H-indol-3-yl)propanoate Traditional Name: (2R)-2-(benzylammonio)-3-(1H-indol-3-yl)propionate Formula: C18H18N2O2 MolecularWeight: 294.34772

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)C[NH2+]C(CC2=CNC3=CC=CC=C32)C(=O)[O-]

Isomeric SMILES

C1=CC=C(C=C1)C[NH2+][C@H](CC2=CNC3=CC=CC=C32)C(=O)[O-]

InChI

InChI=1S/C18H18N2O2/c21-18(22)17(19-11-13-6-2-1-3-7-13)10-14-12-20-16-9-5-4-8-15(14)16/h1-9,12,17,19-20H,10-11H2,(H,21,22)/t17-/m1/s1