1-(1-ethynyl-6,7-dimethoxy-2-prop-2-enyl-3,4-dihydroisoquinolin-1-yl)but-3-en-2-yl ethanoate

Systemtic Name: 1-(1-ethynyl-6,7-dimethoxy-2-prop-2-enyl-3,4-dihydroisoquinolin-1-yl)but-3-en-2-yl ethanoate Openeye Name: 1-[(2-allyl-1-ethynyl-6,7-dimethoxy-3,4-dihydroisoquinolin-1-yl)methyl]allyl acetate CAS Name: acetic acid 1-(1-ethynyl-6,7-dimethoxy-2-prop-2-enyl-3,4-dihydroisoquinolin-1-yl)but-3-en-2-yl ester IUPAC Name: 1-(1-ethynyl-6,7-dimethoxy-2-prop-2-enyl-3,4-dihydroisoquinolin-1-yl)but-3-en-2-yl acetate Traditional Name: acetic acid 1-[(2-allyl-1-ethynyl-6,7-dimethoxy-3,4-dihydroisoquinolin-1-yl)methyl]allyl ester Formula: C22H27NO4 MolecularWeight: 369.45408

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)OC(CC1(C2=CC(=C(C=C2CCN1CC=C)OC)OC)C#C)C=C

Isomeric SMILES

CC(=O)OC(CC1(C2=CC(=C(C=C2CCN1CC=C)OC)OC)C#C)C=C

InChI

InChI=1S/C22H27NO4/c1-7-11-23-12-10-17-13-20(25-5)21(26-6)14-19(17)22(23,9-3)15-18(8-2)27-16(4)24/h3,7-8,13-14,18H,1-2,10-12,15H2,4-6H3