1-butanoyl-4-(phenylmethyl)-3-quinolin-7-yl-piperazin-2-one

Systemtic Name: 1-butanoyl-4-(phenylmethyl)-3-quinolin-7-yl-piperazin-2-one Openeye Name: 4-benzyl-1-butanoyl-3-(7-quinolyl)piperazin-2-one CAS Name: 1-(1-oxobutyl)-4-(phenylmethyl)-3-(7-quinolinyl)-2-piperazinone IUPAC Name: 4-benzyl-1-butanoyl-3-quinolin-7-ylpiperazin-2-one Traditional Name: 4-benzyl-1-butyryl-3-(7-quinolyl)piperazin-2-one Formula: C24H25N3O2 MolecularWeight: 387.4742

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Descriptors Computed from Structure

Canonical SMILES:

CCCC(=O)N1CCN(C(C1=O)C2=CC3=C(C=CC=N3)C=C2)CC4=CC=CC=C4

Isomeric SMILES

CCCC(=O)N1CCN(C(C1=O)C2=CC3=C(C=CC=N3)C=C2)CC4=CC=CC=C4

InChI

InChI=1S/C24H25N3O2/c1-2-7-22(28)27-15-14-26(17-18-8-4-3-5-9-18)23(24(27)29)20-12-11-19-10-6-13-25-21(19)16-20/h3-6,8-13,16,23H,2,7,14-15,17H2,1H3