4-(5-cyclopentyloxy-6-methoxy-2-oxidanidyl-3,4-dihydroisoquinolin-1-ylidene)pyridin-1-ium 1-oxide

Systemtic Name: 4-(5-cyclopentyloxy-6-methoxy-2-oxidanidyl-3,4-dihydroisoquinolin-1-ylidene)pyridin-1-ium 1-oxide Openeye Name: 4-[5-(cyclopentoxy)-6-methoxy-2-oxido-3,4-dihydroisoquinolin-1-ylidene]pyridin-1-ium 1-oxide CAS Name: 4-(5-cyclopentyloxy-6-methoxy-2-oxido-3,4-dihydroisoquinolin-1-ylidene)pyridin-1-ium 1-oxide IUPAC Name: 4-(5-cyclopentyloxy-6-methoxy-2-oxido-3,4-dihydroisoquinolin-1-ylidene)pyridin-1-ium 1-oxide Traditional Name: 4-[5-(cyclopentoxy)-6-methoxy-2-oxido-3,4-dihydroisoquinolin-1-ylidene]pyridin-1-ium 1-oxide Formula: C20H22N2O4 MolecularWeight: 354.39968

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C2=C(C=C1)C(=C3C=C[N+](=O)C=C3)N(CC2)[O-])OC4CCCC4

Isomeric SMILES

COC1=C(C2=C(C=C1)C(=C3C=C[N+](=O)C=C3)N(CC2)[O-])OC4CCCC4

InChI

InChI=1S/C20H22N2O4/c1-25-18-7-6-16-17(20(18)26-15-4-2-3-5-15)10-13-22(24)19(16)14-8-11-21(23)12-9-14/h6-9,11-12,15H,2-5,10,13H2,1H3