6,7-dimethoxy-N-(2-methoxy-5-nitro-phenyl)-2-(2-methylpropyl)-1-oxidanylidene-isoquinoline-4-carboxamide

Systemtic Name: 6,7-dimethoxy-N-(2-methoxy-5-nitro-phenyl)-2-(2-methylpropyl)-1-oxidanylidene-isoquinoline-4-carboxamide Openeye Name: 2-isobutyl-6,7-dimethoxy-N-(2-methoxy-5-nitro-phenyl)-1-oxo-isoquinoline-4-carboxamide CAS Name: 6,7-dimethoxy-N-(2-methoxy-5-nitrophenyl)-2-(2-methylpropyl)-1-oxo-4-isoquinolinecarboxamide IUPAC Name: 6,7-dimethoxy-N-(2-methoxy-5-nitrophenyl)-2-(2-methylpropyl)-1-oxoisoquinoline-4-carboxamide Traditional Name: 2-isobutyl-1-keto-6,7-dimethoxy-N-(2-methoxy-5-nitro-phenyl)isoquinoline-4-carboxamide Formula: C23H25N3O7 MolecularWeight: 455.4605

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CN1C=C(C2=CC(=C(C=C2C1=O)OC)OC)C(=O)NC3=C(C=CC(=C3)[N+](=O)[O-])OC

Isomeric SMILES

CC(C)CN1C=C(C2=CC(=C(C=C2C1=O)OC)OC)C(=O)NC3=C(C=CC(=C3)[N+](=O)[O-])OC

InChI

InChI=1S/C23H25N3O7/c1-13(2)11-25-12-17(15-9-20(32-4)21(33-5)10-16(15)23(25)28)22(27)24-18-8-14(26(29)30)6-7-19(18)31-3/h6-10,12-13H,11H2,1-5H3,(H,24,27)