ethyl 1-[[1-oxidanylidene-2-propyl-3-(3,4,5-trimethoxyphenyl)-3,4-dihydroisoquinolin-4-yl]carbonyl]piperidine-3-carboxylate

Systemtic Name: ethyl 1-[[1-oxidanylidene-2-propyl-3-(3,4,5-trimethoxyphenyl)-3,4-dihydroisoquinolin-4-yl]carbonyl]piperidine-3-carboxylate Openeye Name: ethyl 1-[1-oxo-2-propyl-3-(3,4,5-trimethoxyphenyl)-3,4-dihydroisoquinoline-4-carbonyl]piperidine-3-carboxylate CAS Name: 1-[oxo-[1-oxo-2-propyl-3-(3,4,5-trimethoxyphenyl)-3,4-dihydroisoquinolin-4-yl]methyl]-3-piperidinecarboxylic acid ethyl ester IUPAC Name: ethyl 1-[1-oxo-2-propyl-3-(3,4,5-trimethoxyphenyl)-3,4-dihydroisoquinoline-4-carbonyl]piperidine-3-carboxylate Traditional Name: 1-[1-keto-2-propyl-3-(3,4,5-trimethoxyphenyl)-3,4-dihydroisoquinoline-4-carbonyl]nipecotic acid ethyl ester Formula: C30H38N2O7 MolecularWeight: 538.63192

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Descriptors Computed from Structure

Canonical SMILES:

CCCN1C(C(C2=CC=CC=C2C1=O)C(=O)N3CCCC(C3)C(=O)OCC)C4=CC(=C(C(=C4)OC)OC)OC

Isomeric SMILES

CCCN1C(C(C2=CC=CC=C2C1=O)C(=O)N3CCCC(C3)C(=O)OCC)C4=CC(=C(C(=C4)OC)OC)OC

InChI

InChI=1S/C30H38N2O7/c1-6-14-32-26(20-16-23(36-3)27(38-5)24(17-20)37-4)25(21-12-8-9-13-22(21)28(32)33)29(34)31-15-10-11-19(18-31)30(35)39-7-2/h8-9,12-13,16-17,19,25-26H,6-7,10-11,14-15,18H2,1-5H3