N-[bis(azanyl)methylidene]-6,7-dimethoxy-2-naphthalen-2-yl-1-oxidanylidene-isoquinoline-4-carboxamide hydrochloride

Systemtic Name: N-[bis(azanyl)methylidene]-6,7-dimethoxy-2-naphthalen-2-yl-1-oxidanylidene-isoquinoline-4-carboxamide hydrochloride Openeye Name: N-(diaminomethylene)-6,7-dimethoxy-2-(2-naphthyl)-1-oxo-isoquinoline-4-carboxamide hydrochloride CAS Name: N-(diaminomethylidene)-6,7-dimethoxy-2-(2-naphthalenyl)-1-oxo-4-isoquinolinecarboxamide hydrochloride IUPAC Name: N-(diaminomethylidene)-6,7-dimethoxy-2-naphthalen-2-yl-1-oxoisoquinoline-4-carboxamide hydrochloride Traditional Name: N-(diaminomethylene)-1-keto-6,7-dimethoxy-2-(2-naphthyl)isoquinoline-4-carboxamide hydrochloride Formula: C23H21ClN4O4 MolecularWeight: 452.89024

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C2C(=C1)C(=CN(C2=O)C3=CC4=CC=CC=C4C=C3)C(=O)N=C(N)N)OC.Cl

Isomeric SMILES

COC1=C(C=C2C(=C1)C(=CN(C2=O)C3=CC4=CC=CC=C4C=C3)C(=O)N=C(N)N)OC.Cl

InChI

InChI=1S/C23H20N4O4.ClH/c1-30-19-10-16-17(11-20(19)31-2)22(29)27(12-18(16)21(28)26-23(24)25)15-8-7-13-5-3-4-6-14(13)9-15;/h3-12H,1-2H3,(H4,24,25,26,28);1H