2-[4-(4-methyl-3-nitro-phenyl)sulfonylpiperazin-1-yl]-1,3-benzoxazole

Systemtic Name: 2-[4-(4-methyl-3-nitro-phenyl)sulfonylpiperazin-1-yl]-1,3-benzoxazole Openeye Name: 2-[4-(4-methyl-3-nitro-phenyl)sulfonylpiperazin-1-yl]-1,3-benzoxazole CAS Name: 2-[4-(4-methyl-3-nitrophenyl)sulfonyl-1-piperazinyl]-1,3-benzoxazole IUPAC Name: 2-[4-(4-methyl-3-nitrophenyl)sulfonylpiperazin-1-yl]-1,3-benzoxazole Traditional Name: 2-[4-(4-methyl-3-nitro-phenyl)sulfonylpiperazino]-1,3-benzoxazole Formula: C18H18N4O5S MolecularWeight: 402.42432

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)S(=O)(=O)N2CCN(CC2)C3=NC4=CC=CC=C4O3)[N+](=O)[O-]

Isomeric SMILES

CC1=C(C=C(C=C1)S(=O)(=O)N2CCN(CC2)C3=NC4=CC=CC=C4O3)[N+](=O)[O-]

InChI

InChI=1S/C18H18N4O5S/c1-13-6-7-14(12-16(13)22(23)24)28(25,26)21-10-8-20(9-11-21)18-19-15-4-2-3-5-17(15)27-18/h2-7,12H,8-11H2,1H3