4-methyl-N-[2-oxidanylidene-2-[4-(phenylmethyl)-1,4-diazepan-1-yl]ethyl]benzamide

Systemtic Name: 4-methyl-N-[2-oxidanylidene-2-[4-(phenylmethyl)-1,4-diazepan-1-yl]ethyl]benzamide Openeye Name: N-[2-(4-benzyl-1,4-diazepan-1-yl)-2-oxo-ethyl]-4-methyl-benzamide CAS Name: 4-methyl-N-[2-oxo-2-[4-(phenylmethyl)-1,4-diazepan-1-yl]ethyl]benzamide IUPAC Name: N-[2-(4-benzyl-1,4-diazepan-1-yl)-2-oxoethyl]-4-methylbenzamide Traditional Name: N-[2-(4-benzyl-1,4-diazepan-1-yl)-2-keto-ethyl]-4-methyl-benzamide Formula: C22H27N3O2 MolecularWeight: 365.46868

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)C(=O)NCC(=O)N2CCCN(CC2)CC3=CC=CC=C3

Isomeric SMILES

CC1=CC=C(C=C1)C(=O)NCC(=O)N2CCCN(CC2)CC3=CC=CC=C3

InChI

InChI=1S/C22H27N3O2/c1-18-8-10-20(11-9-18)22(27)23-16-21(26)25-13-5-12-24(14-15-25)17-19-6-3-2-4-7-19/h2-4,6-11H,5,12-17H2,1H3,(H,23,27)