1-(3,6-dihydro-2H-pyridin-1-yl)-4-(2-methoxy-4-nitro-phenyl)butan-1-one

Systemtic Name: 1-(3,6-dihydro-2H-pyridin-1-yl)-4-(2-methoxy-4-nitro-phenyl)butan-1-one Openeye Name: 1-(3,6-dihydro-2H-pyridin-1-yl)-4-(2-methoxy-4-nitro-phenyl)butan-1-one CAS Name: 1-(3,6-dihydro-2H-pyridin-1-yl)-4-(2-methoxy-4-nitrophenyl)-1-butanone IUPAC Name: 1-(3,6-dihydro-2H-pyridin-1-yl)-4-(2-methoxy-4-nitrophenyl)butan-1-one Traditional Name: 1-(3,6-dihydro-2H-pyridin-1-yl)-4-(2-methoxy-4-nitro-phenyl)butan-1-one Formula: C16H20N2O4 MolecularWeight: 304.341

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=CC(=C1)[N+](=O)[O-])CCCC(=O)N2CCC=CC2

Isomeric SMILES

COC1=C(C=CC(=C1)[N+](=O)[O-])CCCC(=O)N2CCC=CC2

InChI

InChI=1S/C16H20N2O4/c1-22-15-12-14(18(20)21)9-8-13(15)6-5-7-16(19)17-10-3-2-4-11-17/h2-3,8-9,12H,4-7,10-11H2,1H3