2-[3-methyl-2-[(3-nitrophenyl)amino]pentanoyl]-1,2-diazinane-1-carbonitrile

Systemtic Name: 2-[3-methyl-2-[(3-nitrophenyl)amino]pentanoyl]-1,2-diazinane-1-carbonitrile Openeye Name: 2-[3-methyl-2-(3-nitroanilino)pentanoyl]hexahydropyridazine-1-carbonitrile CAS Name: 2-[3-methyl-2-(3-nitroanilino)-1-oxopentyl]-1-diazinanecarbonitrile IUPAC Name: 2-[3-methyl-2-(3-nitroanilino)pentanoyl]diazinane-1-carbonitrile Traditional Name: 2-[3-methyl-2-(3-nitroanilino)pentanoyl]hexahydropyridazine-1-carbonitrile Formula: C17H23N5O3 MolecularWeight: 345.39622

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C)C(C(=O)N1CCCCN1C#N)NC2=CC(=CC=C2)[N+](=O)[O-]

Isomeric SMILES

CCC(C)C(C(=O)N1CCCCN1C#N)NC2=CC(=CC=C2)[N+](=O)[O-]

InChI

InChI=1S/C17H23N5O3/c1-3-13(2)16(17(23)21-10-5-4-9-20(21)12-18)19-14-7-6-8-15(11-14)22(24)25/h6-8,11,13,16,19H,3-5,9-10H2,1-2H3