6-butoxy-1-[(E)-3-methyl-1-phenyl-but-1-en-2-yl]-3,4-dihydroisoquinoline

Systemtic Name: 6-butoxy-1-[(E)-3-methyl-1-phenyl-but-1-en-2-yl]-3,4-dihydroisoquinoline Openeye Name: 1-[(1E)-1-benzylidene-2-methyl-propyl]-6-butoxy-3,4-dihydroisoquinoline CAS Name: 6-butoxy-1-[(E)-3-methyl-1-phenylbut-1-en-2-yl]-3,4-dihydroisoquinoline IUPAC Name: 6-butoxy-1-[(E)-3-methyl-1-phenylbut-1-en-2-yl]-3,4-dihydroisoquinoline Traditional Name: 6-butoxy-1-[(E)-1-isopropyl-2-phenyl-vinyl]-3,4-dihydroisoquinoline Formula: C24H29NO MolecularWeight: 347.49316

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C24H29NO/c1-4-5-15-26-21-11-12-22-20(17-21)13-14-25-24(22)23(18(2)3)16-19-9-7-6-8-10-19/h6-12,16-18H,4-5,13-15H2,1-3H3/b23-16+