1-(4-ethylpiperazin-1-yl)-3-[4-(nitrosomethylidene)cyclohexa-2,5-dien-1-ylidene]-2H-isoquinoline hydrochloride

Systemtic Name: 1-(4-ethylpiperazin-1-yl)-3-[4-(nitrosomethylidene)cyclohexa-2,5-dien-1-ylidene]-2H-isoquinoline hydrochloride Openeye Name: 1-(4-ethylpiperazin-1-yl)-3-[4-(nitrosomethylene)cyclohexa-2,5-dien-1-ylidene]-2H-isoquinoline hydrochloride CAS Name: 1-(4-ethyl-1-piperazinyl)-3-[4-(nitrosomethylidene)-1-cyclohexa-2,5-dienylidene]-2H-isoquinoline hydrochloride IUPAC Name: 1-(4-ethylpiperazin-1-yl)-3-[4-(nitrosomethylidene)cyclohexa-2,5-dien-1-ylidene]-2H-isoquinoline hydrochloride Traditional Name: 1-(4-ethylpiperazino)-3-[4-(nitrosomethylene)cyclohexa-2,5-dien-1-ylidene]-2H-isoquinoline hydrochloride Formula: C22H25ClN4O MolecularWeight: 396.9131

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Descriptors Computed from Structure

Canonical SMILES:

CCN1CCN(CC1)C2=C3C=CC=CC3=CC(=C4C=CC(=CN=O)C=C4)N2.Cl

Isomeric SMILES

CCN1CCN(CC1)C2=C3C=CC=CC3=CC(=C4C=CC(=CN=O)C=C4)N2.Cl

InChI

InChI=1S/C22H24N4O.ClH/c1-2-25-11-13-26(14-12-25)22-20-6-4-3-5-19(20)15-21(24-22)18-9-7-17(8-10-18)16-23-27;/h3-10,15-16,24H,2,11-14H2,1H3;1H