N-[3-[4-(diphenylmethyl)piperazin-1-yl]-2-oxidanyl-propyl]-N-quinolin-5-yl-ethanamide

Systemtic Name: N-[3-[4-(diphenylmethyl)piperazin-1-yl]-2-oxidanyl-propyl]-N-quinolin-5-yl-ethanamide Openeye Name: N-[3-(4-benzhydrylpiperazin-1-yl)-2-hydroxy-propyl]-N-(5-quinolyl)acetamide CAS Name: N-[3-[4-(diphenylmethyl)-1-piperazinyl]-2-hydroxypropyl]-N-(5-quinolinyl)acetamide IUPAC Name: N-[3-(4-benzhydrylpiperazin-1-yl)-2-hydroxypropyl]-N-quinolin-5-ylacetamide Traditional Name: N-[3-(4-benzhydrylpiperazino)-2-hydroxy-propyl]-N-(5-quinolyl)acetamide Formula: C31H34N4O2 MolecularWeight: 494.62726

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)N(CC(CN1CCN(CC1)C(C2=CC=CC=C2)C3=CC=CC=C3)O)C4=CC=CC5=C4C=CC=N5

Isomeric SMILES

CC(=O)N(CC(CN1CCN(CC1)C(C2=CC=CC=C2)C3=CC=CC=C3)O)C4=CC=CC5=C4C=CC=N5

InChI

InChI=1S/C31H34N4O2/c1-24(36)35(30-16-8-15-29-28(30)14-9-17-32-29)23-27(37)22-33-18-20-34(21-19-33)31(25-10-4-2-5-11-25)26-12-6-3-7-13-26/h2-17,27,31,37H,18-23H2,1H3