2-[[2-[[4-(azepan-1-yl)phenyl]amino]-2-oxidanylidene-ethyl]amino]-N-methyl-ethanamide

Systemtic Name: 2-[[2-[[4-(azepan-1-yl)phenyl]amino]-2-oxidanylidene-ethyl]amino]-N-methyl-ethanamide Openeye Name: 2-[[2-[4-(azepan-1-yl)anilino]-2-oxo-ethyl]amino]-N-methyl-acetamide CAS Name: 2-[[2-[4-(1-azepanyl)anilino]-2-oxoethyl]amino]-N-methylacetamide IUPAC Name: 2-[[2-[4-(azepan-1-yl)anilino]-2-oxoethyl]amino]-N-methylacetamide Traditional Name: 2-[[2-[4-(azepan-1-yl)anilino]-2-keto-ethyl]amino]-N-methyl-acetamide Formula: C17H26N4O2 MolecularWeight: 318.41394

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Descriptors Computed from Structure

Canonical SMILES:

CNC(=O)CNCC(=O)NC1=CC=C(C=C1)N2CCCCCC2

Isomeric SMILES

CNC(=O)CNCC(=O)NC1=CC=C(C=C1)N2CCCCCC2

InChI

InChI=1S/C17H26N4O2/c1-18-16(22)12-19-13-17(23)20-14-6-8-15(9-7-14)21-10-4-2-3-5-11-21/h6-9,19H,2-5,10-13H2,1H3,(H,18,22)(H,20,23)