5-chloranyl-3-[[4-(4-nitrophenyl)piperazin-1-yl]methyl]-1,3-benzoxazol-2-one

Systemtic Name: 5-chloranyl-3-[[4-(4-nitrophenyl)piperazin-1-yl]methyl]-1,3-benzoxazol-2-one Openeye Name: 5-chloro-3-[[4-(4-nitrophenyl)piperazin-1-yl]methyl]-1,3-benzoxazol-2-one CAS Name: 5-chloro-3-[[4-(4-nitrophenyl)-1-piperazinyl]methyl]-1,3-benzoxazol-2-one IUPAC Name: 5-chloro-3-[[4-(4-nitrophenyl)piperazin-1-yl]methyl]-1,3-benzoxazol-2-one Traditional Name: 5-chloro-3-[[4-(4-nitrophenyl)piperazino]methyl]-1,3-benzoxazol-2-one Formula: C18H17ClN4O4 MolecularWeight: 388.80498

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1CN2C3=C(C=CC(=C3)Cl)OC2=O)C4=CC=C(C=C4)[N+](=O)[O-]

Isomeric SMILES

C1CN(CCN1CN2C3=C(C=CC(=C3)Cl)OC2=O)C4=CC=C(C=C4)[N+](=O)[O-]

InChI

InChI=1S/C18H17ClN4O4/c19-13-1-6-17-16(11-13)22(18(24)27-17)12-20-7-9-21(10-8-20)14-2-4-15(5-3-14)23(25)26/h1-6,11H,7-10,12H2