6-butoxy-1-[(E)-2-phenylethenyl]-3,4-dihydroisoquinoline hydrochloride

Systemtic Name: 6-butoxy-1-[(E)-2-phenylethenyl]-3,4-dihydroisoquinoline hydrochloride Openeye Name: 6-butoxy-1-[(E)-styryl]-3,4-dihydroisoquinoline hydrochloride CAS Name: 6-butoxy-1-[(E)-2-phenylethenyl]-3,4-dihydroisoquinoline hydrochloride IUPAC Name: 6-butoxy-1-[(E)-2-phenylethenyl]-3,4-dihydroisoquinoline hydrochloride Traditional Name: 6-butoxy-1-[(E)-styryl]-3,4-dihydroisoquinoline hydrochloride Formula: C21H24ClNO MolecularWeight: 341.87436

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Descriptors Computed from Structure

Canonical SMILES:

CCCCOC1=CC2=C(C=C1)C(=NCC2)C=CC3=CC=CC=C3.Cl

Isomeric SMILES

CCCCOC1=CC2=C(C=C1)C(=NCC2)/C=C/C3=CC=CC=C3.Cl

InChI

InChI=1S/C21H23NO.ClH/c1-2-3-15-23-19-10-11-20-18(16-19)13-14-22-21(20)12-9-17-7-5-4-6-8-17;/h4-12,16H,2-3,13-15H2,1H3;1H/b12-9+;