3-methyl-8-nitro-N-phenyl-1,2,4,4a,5,6-hexahydropyrazino[1,2-a]quinoline-5-carboxamide

Systemtic Name: 3-methyl-8-nitro-N-phenyl-1,2,4,4a,5,6-hexahydropyrazino[1,2-a]quinoline-5-carboxamide Openeye Name: 3-methyl-8-nitro-N-phenyl-1,2,4,4a,5,6-hexahydropyrazino[1,2-a]quinoline-5-carboxamide CAS Name: 3-methyl-8-nitro-N-phenyl-1,2,4,4a,5,6-hexahydropyrazino[1,2-a]quinoline-5-carboxamide IUPAC Name: 3-methyl-8-nitro-N-phenyl-1,2,4,4a,5,6-hexahydropyrazino[1,2-a]quinoline-5-carboxamide Traditional Name: 3-methyl-8-nitro-N-phenyl-1,2,4,4a,5,6-hexahydropyrazino[1,2-a]quinoline-5-carboxamide Formula: C20H22N4O3 MolecularWeight: 366.41368

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Descriptors Computed from Structure

Canonical SMILES:

CN1CCN2C(C1)C(CC3=C2C=CC(=C3)[N+](=O)[O-])C(=O)NC4=CC=CC=C4

Isomeric SMILES

CN1CCN2C(C1)C(CC3=C2C=CC(=C3)[N+](=O)[O-])C(=O)NC4=CC=CC=C4

InChI

InChI=1S/C20H22N4O3/c1-22-9-10-23-18-8-7-16(24(26)27)11-14(18)12-17(19(23)13-22)20(25)21-15-5-3-2-4-6-15/h2-8,11,17,19H,9-10,12-13H2,1H3,(H,21,25)