(3,5-dimethylphenyl)methyl 2-azanyl-2-(1H-indol-3-yl)propanoate hydrochloride

Systemtic Name: (3,5-dimethylphenyl)methyl 2-azanyl-2-(1H-indol-3-yl)propanoate hydrochloride Openeye Name: (3,5-dimethylphenyl)methyl 2-amino-2-(1H-indol-3-yl)propanoate hydrochloride CAS Name: 2-amino-2-(1H-indol-3-yl)propanoic acid (3,5-dimethylphenyl)methyl ester hydrochloride IUPAC Name: (3,5-dimethylphenyl)methyl 2-amino-2-(1H-indol-3-yl)propanoate hydrochloride Traditional Name: 2-amino-2-(1H-indol-3-yl)propionic acid (3,5-dimethylbenzyl) ester hydrochloride Formula: C20H23ClN2O2 MolecularWeight: 358.86182

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC(=C1)COC(=O)C(C)(C2=CNC3=CC=CC=C32)N)C.Cl

Isomeric SMILES

CC1=CC(=CC(=C1)COC(=O)C(C)(C2=CNC3=CC=CC=C32)N)C.Cl

InChI

InChI=1S/C20H22N2O2.ClH/c1-13-8-14(2)10-15(9-13)12-24-19(23)20(3,21)17-11-22-18-7-5-4-6-16(17)18;/h4-11,22H,12,21H2,1-3H3;1H