3,4-dihydro-1H-isoquinolin-2-yl-[1-(2-phenylpropyl)piperidin-4-yl]methanone; ethanedioic acid

Systemtic Name: 3,4-dihydro-1H-isoquinolin-2-yl-[1-(2-phenylpropyl)piperidin-4-yl]methanone; ethanedioic acid Openeye Name: 3,4-dihydro-1H-isoquinolin-2-yl-[1-(2-phenylpropyl)-4-piperidyl]methanone; oxalic acid CAS Name: 3,4-dihydro-1H-isoquinolin-2-yl-[1-(2-phenylpropyl)-4-piperidinyl]methanone; oxalic acid IUPAC Name: 3,4-dihydro-1H-isoquinolin-2-yl-[1-(2-phenylpropyl)piperidin-4-yl]methanone; oxalic acid Traditional Name: 3,4-dihydro-1H-isoquinolin-2-yl-[1-(2-phenylpropyl)-4-piperidyl]methanone; oxalic acid Formula: C26H32N2O5 MolecularWeight: 452.54268

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Descriptors Computed from Structure

Canonical SMILES:

CC(CN1CCC(CC1)C(=O)N2CCC3=CC=CC=C3C2)C4=CC=CC=C4.C(=O)(C(=O)O)O

Isomeric SMILES

CC(CN1CCC(CC1)C(=O)N2CCC3=CC=CC=C3C2)C4=CC=CC=C4.C(=O)(C(=O)O)O

InChI

InChI=1S/C24H30N2O.C2H2O4/c1-19(20-7-3-2-4-8-20)17-25-14-11-22(12-15-25)24(27)26-16-13-21-9-5-6-10-23(21)18-26;3-1(4)2(5)6/h2-10,19,22H,11-18H2,1H3;(H,3,4)(H,5,6)