4-chloranyl-N-[4-[4-[(4-methylphenyl)methyl]-1,4-diazepan-1-yl]-4-oxidanylidene-butyl]benzamide

Systemtic Name: 4-chloranyl-N-[4-[4-[(4-methylphenyl)methyl]-1,4-diazepan-1-yl]-4-oxidanylidene-butyl]benzamide Openeye Name: 4-chloro-N-[4-oxo-4-[4-(p-tolylmethyl)-1,4-diazepan-1-yl]butyl]benzamide CAS Name: 4-chloro-N-[4-[4-[(4-methylphenyl)methyl]-1,4-diazepan-1-yl]-4-oxobutyl]benzamide IUPAC Name: 4-chloro-N-[4-[4-[(4-methylphenyl)methyl]-1,4-diazepan-1-yl]-4-oxobutyl]benzamide Traditional Name: 4-chloro-N-[4-keto-4-[4-(4-methylbenzyl)-1,4-diazepan-1-yl]butyl]benzamide Formula: C24H30ClN3O2 MolecularWeight: 427.9669

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C24H30ClN3O2/c1-19-5-7-20(8-6-19)18-27-14-3-15-28(17-16-27)23(29)4-2-13-26-24(30)21-9-11-22(25)12-10-21/h5-12H,2-4,13-18H2,1H3,(H,26,30)