(Z)-1-[6,7-dimethoxy-1-(phenylmethyl)-3,4-dihydro-1H-isoquinolin-2-yl]octadec-9-en-1-one

Systemtic Name: (Z)-1-[6,7-dimethoxy-1-(phenylmethyl)-3,4-dihydro-1H-isoquinolin-2-yl]octadec-9-en-1-one Openeye Name: (Z)-1-(1-benzyl-6,7-dimethoxy-3,4-dihydro-1H-isoquinolin-2-yl)octadec-9-en-1-one CAS Name: (Z)-1-[6,7-dimethoxy-1-(phenylmethyl)-3,4-dihydro-1H-isoquinolin-2-yl]-9-octadecen-1-one IUPAC Name: (Z)-1-(1-benzyl-6,7-dimethoxy-3,4-dihydro-1H-isoquinolin-2-yl)octadec-9-en-1-one Traditional Name: (Z)-1-(1-benzyl-6,7-dimethoxy-3,4-dihydro-1H-isoquinolin-2-yl)octadec-9-en-1-one Formula: C36H53NO3 MolecularWeight: 547.81092

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCC=CCCCCCCCC(=O)N1CCC2=CC(=C(C=C2C1CC3=CC=CC=C3)OC)OC

Isomeric SMILES

CCCCCCCC/C=C\CCCCCCCC(=O)N1CCC2=CC(=C(C=C2C1CC3=CC=CC=C3)OC)OC

InChI

InChI=1S/C36H53NO3/c1-4-5-6-7-8-9-10-11-12-13-14-15-16-17-21-24-36(38)37-26-25-31-28-34(39-2)35(40-3)29-32(31)33(37)27-30-22-19-18-20-23-30/h11-12,18-20,22-23,28-29,33H,4-10,13-17,21,24-27H2,1-3H3/b12-11-