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

Systemtic Name: 4-butoxy-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-butoxy-benzamide CAS Name: 4-butoxy-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-butoxybenzamide Traditional Name: N-[2-(4-benzyl-1,4-diazepan-1-yl)-2-keto-ethyl]-4-butoxy-benzamide Formula: C25H33N3O3 MolecularWeight: 423.54782

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Descriptors Computed from Structure

Canonical SMILES:

CCCCOC1=CC=C(C=C1)C(=O)NCC(=O)N2CCCN(CC2)CC3=CC=CC=C3

Isomeric SMILES

CCCCOC1=CC=C(C=C1)C(=O)NCC(=O)N2CCCN(CC2)CC3=CC=CC=C3

InChI

InChI=1S/C25H33N3O3/c1-2-3-18-31-23-12-10-22(11-13-23)25(30)26-19-24(29)28-15-7-14-27(16-17-28)20-21-8-5-4-6-9-21/h4-6,8-13H,2-3,7,14-20H2,1H3,(H,26,30)