N-(3-chloranyl-2-methyl-phenyl)-2-[4-[(4-methylphenyl)methyl]-1,4-diazepan-1-yl]ethanamide

Systemtic Name: N-(3-chloranyl-2-methyl-phenyl)-2-[4-[(4-methylphenyl)methyl]-1,4-diazepan-1-yl]ethanamide Openeye Name: N-(3-chloro-2-methyl-phenyl)-2-[4-(p-tolylmethyl)-1,4-diazepan-1-yl]acetamide CAS Name: N-(3-chloro-2-methylphenyl)-2-[4-[(4-methylphenyl)methyl]-1,4-diazepan-1-yl]acetamide IUPAC Name: N-(3-chloro-2-methylphenyl)-2-[4-[(4-methylphenyl)methyl]-1,4-diazepan-1-yl]acetamide Traditional Name: N-(3-chloro-2-methyl-phenyl)-2-[4-(4-methylbenzyl)-1,4-diazepan-1-yl]acetamide Formula: C22H28ClN3O MolecularWeight: 385.93022

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)CN2CCCN(CC2)CC(=O)NC3=C(C(=CC=C3)Cl)C

Isomeric SMILES

CC1=CC=C(C=C1)CN2CCCN(CC2)CC(=O)NC3=C(C(=CC=C3)Cl)C

InChI

InChI=1S/C22H28ClN3O/c1-17-7-9-19(10-8-17)15-25-11-4-12-26(14-13-25)16-22(27)24-21-6-3-5-20(23)18(21)2/h3,5-10H,4,11-16H2,1-2H3,(H,24,27)