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

Systemtic Name: 5-[4-[4-(diphenylmethyl)piperazin-1-yl]butyl]-3-(3-nitrophenyl)-1,2-oxazole Openeye Name: 5-[4-(4-benzhydrylpiperazin-1-yl)butyl]-3-(3-nitrophenyl)isoxazole CAS Name: 5-[4-[4-(diphenylmethyl)-1-piperazinyl]butyl]-3-(3-nitrophenyl)isoxazole IUPAC Name: 5-[4-(4-benzhydrylpiperazin-1-yl)butyl]-3-(3-nitrophenyl)-1,2-oxazole Traditional Name: 5-[4-(4-benzhydrylpiperazino)butyl]-3-(3-nitrophenyl)isoxazole Formula: C30H32N4O3 MolecularWeight: 496.60008

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1CCCCC2=CC(=NO2)C3=CC(=CC=C3)[N+](=O)[O-])C(C4=CC=CC=C4)C5=CC=CC=C5

Isomeric SMILES

C1CN(CCN1CCCCC2=CC(=NO2)C3=CC(=CC=C3)[N+](=O)[O-])C(C4=CC=CC=C4)C5=CC=CC=C5

InChI

InChI=1S/C30H32N4O3/c35-34(36)27-15-9-14-26(22-27)29-23-28(37-31-29)16-7-8-17-32-18-20-33(21-19-32)30(24-10-3-1-4-11-24)25-12-5-2-6-13-25/h1-6,9-15,22-23,30H,7-8,16-21H2