methyl 4-[[(2R)-1-[(2-cyanophenyl)amino]-1-oxidanylidene-propan-2-yl]amino]benzoate

Systemtic Name: methyl 4-[[(2R)-1-[(2-cyanophenyl)amino]-1-oxidanylidene-propan-2-yl]amino]benzoate Openeye Name: methyl 4-[[(1R)-2-(2-cyanoanilino)-1-methyl-2-oxo-ethyl]amino]benzoate CAS Name: 4-[[(2R)-1-(2-cyanoanilino)-1-oxopropan-2-yl]amino]benzoic acid methyl ester IUPAC Name: methyl 4-[[(2R)-1-(2-cyanoanilino)-1-oxopropan-2-yl]amino]benzoate Traditional Name: 4-[[(1R)-2-(2-cyanoanilino)-2-keto-1-methyl-ethyl]amino]benzoic acid methyl ester Formula: C18H17N3O3 MolecularWeight: 323.34588

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)NC1=CC=CC=C1C#N)NC2=CC=C(C=C2)C(=O)OC

Isomeric SMILES

C[C@H](C(=O)NC1=CC=CC=C1C#N)NC2=CC=C(C=C2)C(=O)OC

InChI

InChI=1S/C18H17N3O3/c1-12(17(22)21-16-6-4-3-5-14(16)11-19)20-15-9-7-13(8-10-15)18(23)24-2/h3-10,12,20H,1-2H3,(H,21,22)/t12-/m1/s1