ethyl 4-[4-[4-(3,4-dihydro-1H-isoquinolin-2-yl)piperidin-1-yl]phenyl]carbonylpiperazine-1-carboxylate

Systemtic Name: ethyl 4-[4-[4-(3,4-dihydro-1H-isoquinolin-2-yl)piperidin-1-yl]phenyl]carbonylpiperazine-1-carboxylate Openeye Name: ethyl 4-[4-[4-(3,4-dihydro-1H-isoquinolin-2-yl)-1-piperidyl]benzoyl]piperazine-1-carboxylate CAS Name: 4-[[4-[4-(3,4-dihydro-1H-isoquinolin-2-yl)-1-piperidinyl]phenyl]-oxomethyl]-1-piperazinecarboxylic acid ethyl ester IUPAC Name: ethyl 4-[4-[4-(3,4-dihydro-1H-isoquinolin-2-yl)piperidin-1-yl]benzoyl]piperazine-1-carboxylate Traditional Name: 4-[4-[4-(3,4-dihydro-1H-isoquinolin-2-yl)piperidino]benzoyl]piperazine-1-carboxylic acid ethyl ester Formula: C28H36N4O3 MolecularWeight: 476.61044

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)N1CCN(CC1)C(=O)C2=CC=C(C=C2)N3CCC(CC3)N4CCC5=CC=CC=C5C4

Isomeric SMILES

CCOC(=O)N1CCN(CC1)C(=O)C2=CC=C(C=C2)N3CCC(CC3)N4CCC5=CC=CC=C5C4

InChI

InChI=1S/C28H36N4O3/c1-2-35-28(34)31-19-17-30(18-20-31)27(33)23-7-9-25(10-8-23)29-15-12-26(13-16-29)32-14-11-22-5-3-4-6-24(22)21-32/h3-10,26H,2,11-21H2,1H3