4,6,7-trimethoxy-N-[(5-nitro-2-oxidanyl-phenyl)methyl]-1H-indole-2-carboxamide

Systemtic Name: 4,6,7-trimethoxy-N-[(5-nitro-2-oxidanyl-phenyl)methyl]-1H-indole-2-carboxamide Openeye Name: N-[(2-hydroxy-5-nitro-phenyl)methyl]-4,6,7-trimethoxy-1H-indole-2-carboxamide CAS Name: N-[(2-hydroxy-5-nitrophenyl)methyl]-4,6,7-trimethoxy-1H-indole-2-carboxamide IUPAC Name: N-[(2-hydroxy-5-nitrophenyl)methyl]-4,6,7-trimethoxy-1H-indole-2-carboxamide Traditional Name: N-(2-hydroxy-5-nitro-benzyl)-4,6,7-trimethoxy-1H-indole-2-carboxamide Formula: C19H19N3O7 MolecularWeight: 401.37006

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC(=C(C2=C1C=C(N2)C(=O)NCC3=C(C=CC(=C3)[N+](=O)[O-])O)OC)OC

Isomeric SMILES

COC1=CC(=C(C2=C1C=C(N2)C(=O)NCC3=C(C=CC(=C3)[N+](=O)[O-])O)OC)OC

InChI

InChI=1S/C19H19N3O7/c1-27-15-8-16(28-2)18(29-3)17-12(15)7-13(21-17)19(24)20-9-10-6-11(22(25)26)4-5-14(10)23/h4-8,21,23H,9H2,1-3H3,(H,20,24)