O1,O1'-diethyl O4-methyl 3-methyl-5,6,7,8-tetrahydro-2H-isoquinoline-1,1,4-tricarboxylate

Systemtic Name: O1,O1'-diethyl O4-methyl 3-methyl-5,6,7,8-tetrahydro-2H-isoquinoline-1,1,4-tricarboxylate Openeye Name: O1,O1'-diethyl O4-methyl 3-methyl-5,6,7,8-tetrahydro-2H-isoquinoline-1,1,4-tricarboxylate CAS Name: 3-methyl-5,6,7,8-tetrahydro-2H-isoquinoline-1,1,4-tricarboxylic acid O1,O1'-diethyl ester O4-methyl ester IUPAC Name: 1-O,1-O'-diethyl 4-O-methyl 3-methyl-5,6,7,8-tetrahydro-2H-isoquinoline-1,1,4-tricarboxylate Traditional Name: 3-methyl-5,6,7,8-tetrahydro-2H-isoquinoline-1,1,4-tricarboxylic acid O1,O1'-diethyl ester O4-methyl ester Formula: C18H25NO6 MolecularWeight: 351.3942

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1(C2=C(CCCC2)C(=C(N1)C)C(=O)OC)C(=O)OCC

Isomeric SMILES

CCOC(=O)C1(C2=C(CCCC2)C(=C(N1)C)C(=O)OC)C(=O)OCC

InChI

InChI=1S/C18H25NO6/c1-5-24-16(21)18(17(22)25-6-2)13-10-8-7-9-12(13)14(11(3)19-18)15(20)23-4/h19H,5-10H2,1-4H3