2-chloranyl-N-[1-oxidanylidene-1-[4-(phenylmethyl)-1,4-diazepan-1-yl]propan-2-yl]benzamide

Systemtic Name: 2-chloranyl-N-[1-oxidanylidene-1-[4-(phenylmethyl)-1,4-diazepan-1-yl]propan-2-yl]benzamide Openeye Name: N-[2-(4-benzyl-1,4-diazepan-1-yl)-1-methyl-2-oxo-ethyl]-2-chloro-benzamide CAS Name: 2-chloro-N-[1-oxo-1-[4-(phenylmethyl)-1,4-diazepan-1-yl]propan-2-yl]benzamide IUPAC Name: N-[1-(4-benzyl-1,4-diazepan-1-yl)-1-oxopropan-2-yl]-2-chlorobenzamide Traditional Name: N-[2-(4-benzyl-1,4-diazepan-1-yl)-2-keto-1-methyl-ethyl]-2-chloro-benzamide Formula: C22H26ClN3O2 MolecularWeight: 399.91374

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)N1CCCN(CC1)CC2=CC=CC=C2)NC(=O)C3=CC=CC=C3Cl

Isomeric SMILES

CC(C(=O)N1CCCN(CC1)CC2=CC=CC=C2)NC(=O)C3=CC=CC=C3Cl

InChI

InChI=1S/C22H26ClN3O2/c1-17(24-21(27)19-10-5-6-11-20(19)23)22(28)26-13-7-12-25(14-15-26)16-18-8-3-2-4-9-18/h2-6,8-11,17H,7,12-16H2,1H3,(H,24,27)