N-[2-(4,5-dimethoxy-2-nitro-phenyl)ethyl]-3-oxidanyl-naphthalene-2-carboxamide

Systemtic Name: N-[2-(4,5-dimethoxy-2-nitro-phenyl)ethyl]-3-oxidanyl-naphthalene-2-carboxamide Openeye Name: N-[2-(4,5-dimethoxy-2-nitro-phenyl)ethyl]-3-hydroxy-naphthalene-2-carboxamide CAS Name: N-[2-(4,5-dimethoxy-2-nitrophenyl)ethyl]-3-hydroxy-2-naphthalenecarboxamide IUPAC Name: N-[2-(4,5-dimethoxy-2-nitrophenyl)ethyl]-3-hydroxynaphthalene-2-carboxamide Traditional Name: N-[2-(4,5-dimethoxy-2-nitro-phenyl)ethyl]-3-hydroxy-2-naphthamide Formula: C21H20N2O6 MolecularWeight: 396.3933

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C(=C1)CCNC(=O)C2=CC3=CC=CC=C3C=C2O)[N+](=O)[O-])OC

Isomeric SMILES

COC1=C(C=C(C(=C1)CCNC(=O)C2=CC3=CC=CC=C3C=C2O)[N+](=O)[O-])OC

InChI

InChI=1S/C21H20N2O6/c1-28-19-11-15(17(23(26)27)12-20(19)29-2)7-8-22-21(25)16-9-13-5-3-4-6-14(13)10-18(16)24/h3-6,9-12,24H,7-8H2,1-2H3,(H,22,25)