N-(2-methyl-3-nitro-phenyl)-8-oxidanylidene-5,6,13,13a-tetrahydroisoquinolino[2,1-b]isoquinoline-13-carboxamide

Systemtic Name: N-(2-methyl-3-nitro-phenyl)-8-oxidanylidene-5,6,13,13a-tetrahydroisoquinolino[2,1-b]isoquinoline-13-carboxamide Openeye Name: N-(2-methyl-3-nitro-phenyl)-8-oxo-5,6,13,13a-tetrahydroisoquinolino[2,1-b]isoquinoline-13-carboxamide CAS Name: N-(2-methyl-3-nitrophenyl)-8-oxo-5,6,13,13a-tetrahydroisoquinolino[2,1-b]isoquinoline-13-carboxamide IUPAC Name: N-(2-methyl-3-nitrophenyl)-8-oxo-5,6,13,13a-tetrahydroisoquinolino[2,1-b]isoquinoline-13-carboxamide Traditional Name: 8-keto-N-(2-methyl-3-nitro-phenyl)-5,6,13,13a-tetrahydroisoquinolin[2,1-b]isoquinoline-13-carboxamide Formula: C25H21N3O4 MolecularWeight: 427.45194

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=CC=C1[N+](=O)[O-])NC(=O)C2C3C4=CC=CC=C4CCN3C(=O)C5=CC=CC=C25

Isomeric SMILES

CC1=C(C=CC=C1[N+](=O)[O-])NC(=O)C2C3C4=CC=CC=C4CCN3C(=O)C5=CC=CC=C25

InChI

InChI=1S/C25H21N3O4/c1-15-20(11-6-12-21(15)28(31)32)26-24(29)22-18-9-4-5-10-19(18)25(30)27-14-13-16-7-2-3-8-17(16)23(22)27/h2-12,22-23H,13-14H2,1H3,(H,26,29)