methyl 2-(4-methoxycyclohexyl)carbonyl-3,4-dihydro-1H-isoquinoline-7-carboxylate

Systemtic Name: methyl 2-(4-methoxycyclohexyl)carbonyl-3,4-dihydro-1H-isoquinoline-7-carboxylate Openeye Name: methyl 2-(4-methoxycyclohexanecarbonyl)-3,4-dihydro-1H-isoquinoline-7-carboxylate CAS Name: 2-[(4-methoxycyclohexyl)-oxomethyl]-3,4-dihydro-1H-isoquinoline-7-carboxylic acid methyl ester IUPAC Name: methyl 2-(4-methoxycyclohexanecarbonyl)-3,4-dihydro-1H-isoquinoline-7-carboxylate Traditional Name: 2-(4-methoxycyclohexanecarbonyl)-3,4-dihydro-1H-isoquinoline-7-carboxylic acid methyl ester Formula: C19H25NO4 MolecularWeight: 331.4061

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Descriptors Computed from Structure

Canonical SMILES:

COC1CCC(CC1)C(=O)N2CCC3=C(C2)C=C(C=C3)C(=O)OC

Isomeric SMILES

COC1CCC(CC1)C(=O)N2CCC3=C(C2)C=C(C=C3)C(=O)OC

InChI

InChI=1S/C19H25NO4/c1-23-17-7-5-14(6-8-17)18(21)20-10-9-13-3-4-15(19(22)24-2)11-16(13)12-20/h3-4,11,14,17H,5-10,12H2,1-2H3