N-[[2-chloranyl-5-[(1-methylpyrrolidin-2-yl)methoxy]pyridin-3-yl]methyl]-3-nitro-benzamide

Systemtic Name: N-[[2-chloranyl-5-[(1-methylpyrrolidin-2-yl)methoxy]pyridin-3-yl]methyl]-3-nitro-benzamide Openeye Name: N-[[2-chloro-5-[(1-methylpyrrolidin-2-yl)methoxy]-3-pyridyl]methyl]-3-nitro-benzamide CAS Name: N-[[2-chloro-5-[(1-methyl-2-pyrrolidinyl)methoxy]-3-pyridinyl]methyl]-3-nitrobenzamide IUPAC Name: N-[[2-chloro-5-[(1-methylpyrrolidin-2-yl)methoxy]pyridin-3-yl]methyl]-3-nitrobenzamide Traditional Name: N-[[2-chloro-5-[(1-methylpyrrolidin-2-yl)methoxy]-3-pyridyl]methyl]-3-nitro-benzamide Formula: C19H21ClN4O4 MolecularWeight: 404.84744

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Descriptors Computed from Structure

Canonical SMILES:

CN1CCCC1COC2=CN=C(C(=C2)CNC(=O)C3=CC(=CC=C3)[N+](=O)[O-])Cl

Isomeric SMILES

CN1CCCC1COC2=CN=C(C(=C2)CNC(=O)C3=CC(=CC=C3)[N+](=O)[O-])Cl

InChI

InChI=1S/C19H21ClN4O4/c1-23-7-3-6-16(23)12-28-17-9-14(18(20)21-11-17)10-22-19(25)13-4-2-5-15(8-13)24(26)27/h2,4-5,8-9,11,16H,3,6-7,10,12H2,1H3,(H,22,25)