N-[1-[2-(4-azanylbutylamino)-2-oxidanylidene-ethyl]-2-oxidanylidene-azepan-3-yl]-4-phenyl-benzamide

Systemtic Name: N-[1-[2-(4-azanylbutylamino)-2-oxidanylidene-ethyl]-2-oxidanylidene-azepan-3-yl]-4-phenyl-benzamide Openeye Name: N-[1-[2-(4-aminobutylamino)-2-oxo-ethyl]-2-oxo-azepan-3-yl]-4-phenyl-benzamide CAS Name: N-[1-[2-(4-aminobutylamino)-2-oxoethyl]-2-oxo-3-azepanyl]-4-phenylbenzamide IUPAC Name: N-[1-[2-(4-aminobutylamino)-2-oxoethyl]-2-oxoazepan-3-yl]-4-phenylbenzamide Traditional Name: N-[1-[2-(4-aminobutylamino)-2-keto-ethyl]-2-keto-azepan-3-yl]-4-phenyl-benzamide Formula: C25H32N4O3 MolecularWeight: 436.54658

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Descriptors Computed from Structure

Canonical SMILES:

C1CCN(C(=O)C(C1)NC(=O)C2=CC=C(C=C2)C3=CC=CC=C3)CC(=O)NCCCCN

Isomeric SMILES

C1CCN(C(=O)C(C1)NC(=O)C2=CC=C(C=C2)C3=CC=CC=C3)CC(=O)NCCCCN

InChI

InChI=1S/C25H32N4O3/c26-15-5-6-16-27-23(30)18-29-17-7-4-10-22(25(29)32)28-24(31)21-13-11-20(12-14-21)19-8-2-1-3-9-19/h1-3,8-9,11-14,22H,4-7,10,15-18,26H2,(H,27,30)(H,28,31)