N-[(2S)-1-[(3-cyanophenyl)amino]-1-oxidanylidene-propan-2-yl]-3,4,5-trimethoxy-benzamide

Systemtic Name: N-[(2S)-1-[(3-cyanophenyl)amino]-1-oxidanylidene-propan-2-yl]-3,4,5-trimethoxy-benzamide Openeye Name: N-[(1S)-2-(3-cyanoanilino)-1-methyl-2-oxo-ethyl]-3,4,5-trimethoxy-benzamide CAS Name: N-[(2S)-1-(3-cyanoanilino)-1-oxopropan-2-yl]-3,4,5-trimethoxybenzamide IUPAC Name: N-[(2S)-1-(3-cyanoanilino)-1-oxopropan-2-yl]-3,4,5-trimethoxybenzamide Traditional Name: N-[(1S)-2-(3-cyanoanilino)-2-keto-1-methyl-ethyl]-3,4,5-trimethoxy-benzamide Formula: C20H21N3O5 MolecularWeight: 383.39784

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)NC1=CC=CC(=C1)C#N)NC(=O)C2=CC(=C(C(=C2)OC)OC)OC

Isomeric SMILES

C[C@@H](C(=O)NC1=CC=CC(=C1)C#N)NC(=O)C2=CC(=C(C(=C2)OC)OC)OC

InChI

InChI=1S/C20H21N3O5/c1-12(19(24)23-15-7-5-6-13(8-15)11-21)22-20(25)14-9-16(26-2)18(28-4)17(10-14)27-3/h5-10,12H,1-4H3,(H,22,25)(H,23,24)/t12-/m0/s1