1-[4-(diphenylmethyl)piperazin-1-yl]-3-(7-nitroquinolin-5-yl)oxy-propan-2-ol

Systemtic Name: 1-[4-(diphenylmethyl)piperazin-1-yl]-3-(7-nitroquinolin-5-yl)oxy-propan-2-ol Openeye Name: 1-(4-benzhydrylpiperazin-1-yl)-3-[(7-nitro-5-quinolyl)oxy]propan-2-ol CAS Name: 1-[4-(diphenylmethyl)-1-piperazinyl]-3-[(7-nitro-5-quinolinyl)oxy]-2-propanol IUPAC Name: 1-(4-benzhydrylpiperazin-1-yl)-3-(7-nitroquinolin-5-yl)oxypropan-2-ol Traditional Name: 1-(4-benzhydrylpiperazino)-3-[(7-nitro-5-quinolyl)oxy]propan-2-ol Formula: C29H30N4O4 MolecularWeight: 498.5729

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1CC(COC2=C3C=CC=NC3=CC(=C2)[N+](=O)[O-])O)C(C4=CC=CC=C4)C5=CC=CC=C5

Isomeric SMILES

C1CN(CCN1CC(COC2=C3C=CC=NC3=CC(=C2)[N+](=O)[O-])O)C(C4=CC=CC=C4)C5=CC=CC=C5

InChI

InChI=1S/C29H30N4O4/c34-25(21-37-28-19-24(33(35)36)18-27-26(28)12-7-13-30-27)20-31-14-16-32(17-15-31)29(22-8-3-1-4-9-22)23-10-5-2-6-11-23/h1-13,18-19,25,29,34H,14-17,20-21H2