N-[(4,6-dimethyl-2-oxidanylidene-1H-pyridin-3-yl)methyl]-5-nitro-2-pyrrolidin-1-yl-benzamide

Systemtic Name: N-[(4,6-dimethyl-2-oxidanylidene-1H-pyridin-3-yl)methyl]-5-nitro-2-pyrrolidin-1-yl-benzamide Openeye Name: N-[(4,6-dimethyl-2-oxo-1H-pyridin-3-yl)methyl]-5-nitro-2-pyrrolidin-1-yl-benzamide CAS Name: N-[(4,6-dimethyl-2-oxo-1H-pyridin-3-yl)methyl]-5-nitro-2-(1-pyrrolidinyl)benzamide IUPAC Name: N-[(4,6-dimethyl-2-oxo-1H-pyridin-3-yl)methyl]-5-nitro-2-pyrrolidin-1-ylbenzamide Traditional Name: N-[(2-keto-4,6-dimethyl-1H-pyridin-3-yl)methyl]-5-nitro-2-pyrrolidino-benzamide Formula: C19H22N4O4 MolecularWeight: 370.40238

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C(=O)N1)CNC(=O)C2=C(C=CC(=C2)[N+](=O)[O-])N3CCCC3)C

Isomeric SMILES

CC1=CC(=C(C(=O)N1)CNC(=O)C2=C(C=CC(=C2)[N+](=O)[O-])N3CCCC3)C

InChI

InChI=1S/C19H22N4O4/c1-12-9-13(2)21-19(25)16(12)11-20-18(24)15-10-14(23(26)27)5-6-17(15)22-7-3-4-8-22/h5-6,9-10H,3-4,7-8,11H2,1-2H3,(H,20,24)(H,21,25)