5-[3-[4-(diphenylmethyl)piperazin-1-yl]propyl]-3-(3-nitrophenyl)-1,2-oxazole

Systemtic Name: 5-[3-[4-(diphenylmethyl)piperazin-1-yl]propyl]-3-(3-nitrophenyl)-1,2-oxazole Openeye Name: 5-[3-(4-benzhydrylpiperazin-1-yl)propyl]-3-(3-nitrophenyl)isoxazole CAS Name: 5-[3-[4-(diphenylmethyl)-1-piperazinyl]propyl]-3-(3-nitrophenyl)isoxazole IUPAC Name: 5-[3-(4-benzhydrylpiperazin-1-yl)propyl]-3-(3-nitrophenyl)-1,2-oxazole Traditional Name: 5-[3-(4-benzhydrylpiperazino)propyl]-3-(3-nitrophenyl)isoxazole Formula: C29H30N4O3 MolecularWeight: 482.5735

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1CCCC2=CC(=NO2)C3=CC(=CC=C3)[N+](=O)[O-])C(C4=CC=CC=C4)C5=CC=CC=C5

Isomeric SMILES

C1CN(CCN1CCCC2=CC(=NO2)C3=CC(=CC=C3)[N+](=O)[O-])C(C4=CC=CC=C4)C5=CC=CC=C5

InChI

InChI=1S/C29H30N4O3/c34-33(35)26-14-7-13-25(21-26)28-22-27(36-30-28)15-8-16-31-17-19-32(20-18-31)29(23-9-3-1-4-10-23)24-11-5-2-6-12-24/h1-7,9-14,21-22,29H,8,15-20H2