(3Z)-3-azanyl-3-[2-(azepan-1-yl)-2-oxidanylidene-ethoxy]imino-N-(2-methylphenyl)propanamide

Systemtic Name: (3Z)-3-azanyl-3-[2-(azepan-1-yl)-2-oxidanylidene-ethoxy]imino-N-(2-methylphenyl)propanamide Openeye Name: (3Z)-3-amino-3-[2-(azepan-1-yl)-2-oxo-ethoxy]imino-N-(o-tolyl)propanamide CAS Name: (3Z)-3-amino-3-[2-(1-azepanyl)-2-oxoethoxy]imino-N-(2-methylphenyl)propanamide IUPAC Name: (3Z)-3-amino-3-[2-(azepan-1-yl)-2-oxoethoxy]imino-N-(2-methylphenyl)propanamide Traditional Name: (3Z)-3-amino-3-[2-(azepan-1-yl)-2-keto-ethyl]oximino-N-(o-tolyl)propionamide Formula: C18H26N4O3 MolecularWeight: 346.42404

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC=C1NC(=O)CC(=NOCC(=O)N2CCCCCC2)N

Isomeric SMILES

CC1=CC=CC=C1NC(=O)C/C(=N/OCC(=O)N2CCCCCC2)/N

InChI

InChI=1S/C18H26N4O3/c1-14-8-4-5-9-15(14)20-17(23)12-16(19)21-25-13-18(24)22-10-6-2-3-7-11-22/h4-5,8-9H,2-3,6-7,10-13H2,1H3,(H2,19,21)(H,20,23)