3,5-dimethyl-N-[2-oxidanylidene-2-[4-(phenylmethyl)-1,4-diazepan-1-yl]ethyl]benzamide

Systemtic Name: 3,5-dimethyl-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]-3,5-dimethyl-benzamide CAS Name: 3,5-dimethyl-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]-3,5-dimethylbenzamide Traditional Name: N-[2-(4-benzyl-1,4-diazepan-1-yl)-2-keto-ethyl]-3,5-dimethyl-benzamide Formula: C23H29N3O2 MolecularWeight: 379.49526

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C23H29N3O2/c1-18-13-19(2)15-21(14-18)23(28)24-16-22(27)26-10-6-9-25(11-12-26)17-20-7-4-3-5-8-20/h3-5,7-8,13-15H,6,9-12,16-17H2,1-2H3,(H,24,28)