[4-(6,7-diacetyloxy-8-chloranyl-2-prop-2-enyl-3,4-dihydro-1H-isoquinolin-4-yl)phenyl] ethanoate hydrobromide

Systemtic Name: [4-(6,7-diacetyloxy-8-chloranyl-2-prop-2-enyl-3,4-dihydro-1H-isoquinolin-4-yl)phenyl] ethanoate hydrobromide Openeye Name: [4-(6,7-diacetoxy-2-allyl-8-chloro-3,4-dihydro-1H-isoquinolin-4-yl)phenyl] acetate hydrobromide CAS Name: acetic acid [4-(6,7-diacetyloxy-8-chloro-2-prop-2-enyl-3,4-dihydro-1H-isoquinolin-4-yl)phenyl] ester hydrobromide IUPAC Name: [4-(6,7-diacetyloxy-8-chloro-2-prop-2-enyl-3,4-dihydro-1H-isoquinolin-4-yl)phenyl] acetate hydrobromide Traditional Name: acetic acid [4-(6,7-diacetoxy-2-allyl-8-chloro-3,4-dihydro-1H-isoquinolin-4-yl)phenyl] ester hydrobromide Formula: C24H25BrClNO6 MolecularWeight: 538.8154

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)OC1=CC=C(C=C1)C2CN(CC3=C(C(=C(C=C23)OC(=O)C)OC(=O)C)Cl)CC=C.Br

Isomeric SMILES

CC(=O)OC1=CC=C(C=C1)C2CN(CC3=C(C(=C(C=C23)OC(=O)C)OC(=O)C)Cl)CC=C.Br

InChI

InChI=1S/C24H24ClNO6.BrH/c1-5-10-26-12-20(17-6-8-18(9-7-17)30-14(2)27)19-11-22(31-15(3)28)24(32-16(4)29)23(25)21(19)13-26;/h5-9,11,20H,1,10,12-13H2,2-4H3;1H