6,7-diacetyloxy-1-[(3,4-diacetyloxyphenyl)methyl]-2-methyl-3,4-dihydroisoquinoline-1-carboxylic acid

Systemtic Name: 6,7-diacetyloxy-1-[(3,4-diacetyloxyphenyl)methyl]-2-methyl-3,4-dihydroisoquinoline-1-carboxylic acid Openeye Name: 6,7-diacetoxy-1-[(3,4-diacetoxyphenyl)methyl]-2-methyl-3,4-dihydroisoquinoline-1-carboxylic acid CAS Name: 6,7-diacetyloxy-1-[(3,4-diacetyloxyphenyl)methyl]-2-methyl-3,4-dihydroisoquinoline-1-carboxylic acid IUPAC Name: 6,7-diacetyloxy-1-[(3,4-diacetyloxyphenyl)methyl]-2-methyl-3,4-dihydroisoquinoline-1-carboxylic acid Traditional Name: 6,7-diacetoxy-1-(3,4-diacetoxybenzyl)-2-methyl-3,4-dihydroisoquinoline-1-carboxylic acid Formula: C26H27NO10 MolecularWeight: 513.49328

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)OC1=C(C=C(C=C1)CC2(C3=CC(=C(C=C3CCN2C)OC(=O)C)OC(=O)C)C(=O)O)OC(=O)C

Isomeric SMILES

CC(=O)OC1=C(C=C(C=C1)CC2(C3=CC(=C(C=C3CCN2C)OC(=O)C)OC(=O)C)C(=O)O)OC(=O)C

InChI

InChI=1S/C26H27NO10/c1-14(28)34-21-7-6-18(10-22(21)35-15(2)29)13-26(25(32)33)20-12-24(37-17(4)31)23(36-16(3)30)11-19(20)8-9-27(26)5/h6-7,10-12H,8-9,13H2,1-5H3,(H,32,33)