2-[1-(phenylmethyl)piperidin-4-yl]-1-(1-pyridin-4-yl-2,3-dihydroindol-5-yl)ethanone dihydrochloride

Systemtic Name: 2-[1-(phenylmethyl)piperidin-4-yl]-1-(1-pyridin-4-yl-2,3-dihydroindol-5-yl)ethanone dihydrochloride Openeye Name: 2-(1-benzyl-4-piperidyl)-1-[1-(4-pyridyl)indolin-5-yl]ethanone dihydrochloride CAS Name: 2-[1-(phenylmethyl)-4-piperidinyl]-1-(1-pyridin-4-yl-2,3-dihydroindol-5-yl)ethanone dihydrochloride IUPAC Name: 2-(1-benzylpiperidin-4-yl)-1-(1-pyridin-4-yl-2,3-dihydroindol-5-yl)ethanone dihydrochloride Traditional Name: 2-(1-benzyl-4-piperidyl)-1-[1-(4-pyridyl)indolin-5-yl]ethanone dihydrochloride Formula: C27H31Cl2N3O MolecularWeight: 484.46054

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCC1CC(=O)C2=CC3=C(C=C2)N(CC3)C4=CC=NC=C4)CC5=CC=CC=C5.Cl.Cl

Isomeric SMILES

C1CN(CCC1CC(=O)C2=CC3=C(C=C2)N(CC3)C4=CC=NC=C4)CC5=CC=CC=C5.Cl.Cl

InChI

InChI=1S/C27H29N3O.2ClH/c31-27(18-21-10-15-29(16-11-21)20-22-4-2-1-3-5-22)24-6-7-26-23(19-24)12-17-30(26)25-8-13-28-14-9-25;;/h1-9,13-14,19,21H,10-12,15-18,20H2;2*1H