methyl (2S)-3-(4-aminophenyl)-2-[(3,5-dimethylphenyl)carbonyl-methyl-amino]propanoate

Systemtic Name: methyl (2S)-3-(4-aminophenyl)-2-[(3,5-dimethylphenyl)carbonyl-methyl-amino]propanoate Openeye Name: methyl (2S)-3-(4-aminophenyl)-2-[(3,5-dimethylbenzoyl)-methyl-amino]propanoate CAS Name: (2S)-3-(4-aminophenyl)-2-[[(3,5-dimethylphenyl)-oxomethyl]-methylamino]propanoic acid methyl ester IUPAC Name: methyl (2S)-3-(4-aminophenyl)-2-[(3,5-dimethylbenzoyl)-methylamino]propanoate Traditional Name: (2S)-3-(4-aminophenyl)-2-[(3,5-dimethylbenzoyl)-methyl-amino]propionic acid methyl ester Formula: C20H24N2O3 MolecularWeight: 340.41616

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC(=C1)C(=O)N(C)C(CC2=CC=C(C=C2)N)C(=O)OC)C

Isomeric SMILES

CC1=CC(=CC(=C1)C(=O)N(C)[C@@H](CC2=CC=C(C=C2)N)C(=O)OC)C

InChI

InChI=1S/C20H24N2O3/c1-13-9-14(2)11-16(10-13)19(23)22(3)18(20(24)25-4)12-15-5-7-17(21)8-6-15/h5-11,18H,12,21H2,1-4H3/t18-/m0/s1