6-butoxy-1-[(E)-2-pyridin-4-ylethenyl]-3,4-dihydroisoquinoline

Systemtic Name: 6-butoxy-1-[(E)-2-pyridin-4-ylethenyl]-3,4-dihydroisoquinoline Openeye Name: 6-butoxy-1-[(E)-2-(4-pyridyl)vinyl]-3,4-dihydroisoquinoline CAS Name: 6-butoxy-1-[(E)-2-pyridin-4-ylethenyl]-3,4-dihydroisoquinoline IUPAC Name: 6-butoxy-1-[(E)-2-pyridin-4-ylethenyl]-3,4-dihydroisoquinoline Traditional Name: 6-butoxy-1-[(E)-2-(4-pyridyl)vinyl]-3,4-dihydroisoquinoline Formula: C20H22N2O MolecularWeight: 306.40148

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Descriptors Computed from Structure

Canonical SMILES:

CCCCOC1=CC2=C(C=C1)C(=NCC2)C=CC3=CC=NC=C3

Isomeric SMILES

CCCCOC1=CC2=C(C=C1)C(=NCC2)/C=C/C3=CC=NC=C3

InChI

InChI=1S/C20H22N2O/c1-2-3-14-23-18-5-6-19-17(15-18)10-13-22-20(19)7-4-16-8-11-21-12-9-16/h4-9,11-12,15H,2-3,10,13-14H2,1H3/b7-4+