N-[4-methyl-3-[(2-oxidanylideneazepan-1-yl)carbonylamino]phenyl]-2-oxidanylidene-azepane-1-carboxamide

Systemtic Name: N-[4-methyl-3-[(2-oxidanylideneazepan-1-yl)carbonylamino]phenyl]-2-oxidanylidene-azepane-1-carboxamide Openeye Name: N-[4-methyl-3-[(2-oxoazepane-1-carbonyl)amino]phenyl]-2-oxo-azepane-1-carboxamide CAS Name: N-[4-methyl-3-[[oxo-(2-oxo-1-azepanyl)methyl]amino]phenyl]-2-oxo-1-azepanecarboxamide IUPAC Name: N-[4-methyl-3-[(2-oxoazepane-1-carbonyl)amino]phenyl]-2-oxoazepane-1-carboxamide Traditional Name: 2-keto-N-[3-[(2-ketoazepane-1-carbonyl)amino]-4-methyl-phenyl]azepane-1-carboxamide Formula: C21H28N4O4 MolecularWeight: 400.47142

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)NC(=O)N2CCCCCC2=O)NC(=O)N3CCCCCC3=O

Isomeric SMILES

CC1=C(C=C(C=C1)NC(=O)N2CCCCCC2=O)NC(=O)N3CCCCCC3=O

InChI

InChI=1S/C21H28N4O4/c1-15-10-11-16(22-20(28)24-12-6-2-4-8-18(24)26)14-17(15)23-21(29)25-13-7-3-5-9-19(25)27/h10-11,14H,2-9,12-13H2,1H3,(H,22,28)(H,23,29)