dimethyl 2-[(S)-[(3-methylphenyl)amino]-phenyl-methyl]propanedioate

Systemtic Name: dimethyl 2-[(S)-[(3-methylphenyl)amino]-phenyl-methyl]propanedioate Openeye Name: dimethyl 2-[(S)-(3-methylanilino)-phenyl-methyl]propanedioate CAS Name: 2-[(S)-(3-methylanilino)-phenylmethyl]propanedioic acid dimethyl ester IUPAC Name: dimethyl 2-[(S)-(3-methylanilino)-phenylmethyl]propanedioate Traditional Name: 2-[(S)-m-toluidino(phenyl)methyl]malonic acid dimethyl ester Formula: C19H21NO4 MolecularWeight: 327.37434

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC=C1)NC(C2=CC=CC=C2)C(C(=O)OC)C(=O)OC

Isomeric SMILES

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

InChI

InChI=1S/C19H21NO4/c1-13-8-7-11-15(12-13)20-17(14-9-5-4-6-10-14)16(18(21)23-2)19(22)24-3/h4-12,16-17,20H,1-3H3/t17-/m1/s1