2-[2-[4-(6,7-dimethoxy-3,4-dihydro-1H-isoquinolin-2-yl)butylcarbamoyl]-4-methyl-phenoxy]ethyl ethanoate

Systemtic Name: 2-[2-[4-(6,7-dimethoxy-3,4-dihydro-1H-isoquinolin-2-yl)butylcarbamoyl]-4-methyl-phenoxy]ethyl ethanoate Openeye Name: 2-[2-[4-(6,7-dimethoxy-3,4-dihydro-1H-isoquinolin-2-yl)butylcarbamoyl]-4-methyl-phenoxy]ethyl acetate CAS Name: acetic acid 2-[2-[[4-(6,7-dimethoxy-3,4-dihydro-1H-isoquinolin-2-yl)butylamino]-oxomethyl]-4-methylphenoxy]ethyl ester IUPAC Name: 2-[2-[4-(6,7-dimethoxy-3,4-dihydro-1H-isoquinolin-2-yl)butylcarbamoyl]-4-methylphenoxy]ethyl acetate Traditional Name: acetic acid 2-[2-[4-(6,7-dimethoxy-3,4-dihydro-1H-isoquinolin-2-yl)butylcarbamoyl]-4-methyl-phenoxy]ethyl ester Formula: C27H36N2O6 MolecularWeight: 484.58454

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1)OCCOC(=O)C)C(=O)NCCCCN2CCC3=CC(=C(C=C3C2)OC)OC

Isomeric SMILES

CC1=CC(=C(C=C1)OCCOC(=O)C)C(=O)NCCCCN2CCC3=CC(=C(C=C3C2)OC)OC

InChI

InChI=1S/C27H36N2O6/c1-19-7-8-24(35-14-13-34-20(2)30)23(15-19)27(31)28-10-5-6-11-29-12-9-21-16-25(32-3)26(33-4)17-22(21)18-29/h7-8,15-17H,5-6,9-14,18H2,1-4H3,(H,28,31)