dimethyl 4-(3,4-dihydroisoquinolin-1-yl)heptanedioate

Systemtic Name: dimethyl 4-(3,4-dihydroisoquinolin-1-yl)heptanedioate Openeye Name: dimethyl 4-(3,4-dihydroisoquinolin-1-yl)heptanedioate CAS Name: 4-(3,4-dihydroisoquinolin-1-yl)heptanedioic acid dimethyl ester IUPAC Name: dimethyl 4-(3,4-dihydroisoquinolin-1-yl)heptanedioate Traditional Name: 4-(3,4-dihydroisoquinolin-1-yl)pimelic acid dimethyl ester Formula: C18H23NO4 MolecularWeight: 317.37952

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)CCC(CCC(=O)OC)C1=NCCC2=CC=CC=C21

Isomeric SMILES

COC(=O)CCC(CCC(=O)OC)C1=NCCC2=CC=CC=C21

InChI

InChI=1S/C18H23NO4/c1-22-16(20)9-7-14(8-10-17(21)23-2)18-15-6-4-3-5-13(15)11-12-19-18/h3-6,14H,7-12H2,1-2H3