4-chloranyl-N-[(2S)-1-[(3,4-dimethoxyphenyl)methylamino]-3-methyl-1-oxidanylidene-butan-2-yl]benzamide

Systemtic Name: 4-chloranyl-N-[(2S)-1-[(3,4-dimethoxyphenyl)methylamino]-3-methyl-1-oxidanylidene-butan-2-yl]benzamide Openeye Name: 4-chloro-N-[(1S)-1-[(3,4-dimethoxyphenyl)methylcarbamoyl]-2-methyl-propyl]benzamide CAS Name: 4-chloro-N-[(2S)-1-[(3,4-dimethoxyphenyl)methylamino]-3-methyl-1-oxobutan-2-yl]benzamide IUPAC Name: 4-chloro-N-[(2S)-1-[(3,4-dimethoxyphenyl)methylamino]-3-methyl-1-oxobutan-2-yl]benzamide Traditional Name: 4-chloro-N-[(1S)-2-methyl-1-(veratrylcarbamoyl)propyl]benzamide Formula: C21H25ClN2O4 MolecularWeight: 404.8872

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C(C(=O)NCC1=CC(=C(C=C1)OC)OC)NC(=O)C2=CC=C(C=C2)Cl

Isomeric SMILES

CC(C)[C@@H](C(=O)NCC1=CC(=C(C=C1)OC)OC)NC(=O)C2=CC=C(C=C2)Cl

InChI

InChI=1S/C21H25ClN2O4/c1-13(2)19(24-20(25)15-6-8-16(22)9-7-15)21(26)23-12-14-5-10-17(27-3)18(11-14)28-4/h5-11,13,19H,12H2,1-4H3,(H,23,26)(H,24,25)/t19-/m0/s1