3-[4-[4-(2,3-dimethylphenyl)piperazin-1-yl]-4-oxidanylidene-butyl]-6-nitro-1,3-benzoxazol-2-one

Systemtic Name: 3-[4-[4-(2,3-dimethylphenyl)piperazin-1-yl]-4-oxidanylidene-butyl]-6-nitro-1,3-benzoxazol-2-one Openeye Name: 3-[4-[4-(2,3-dimethylphenyl)piperazin-1-yl]-4-oxo-butyl]-6-nitro-1,3-benzoxazol-2-one CAS Name: 3-[4-[4-(2,3-dimethylphenyl)-1-piperazinyl]-4-oxobutyl]-6-nitro-1,3-benzoxazol-2-one IUPAC Name: 3-[4-[4-(2,3-dimethylphenyl)piperazin-1-yl]-4-oxobutyl]-6-nitro-1,3-benzoxazol-2-one Traditional Name: 3-[4-[4-(2,3-dimethylphenyl)piperazino]-4-keto-butyl]-6-nitro-1,3-benzoxazol-2-one Formula: C23H26N4O5 MolecularWeight: 438.47634

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=CC=C1)N2CCN(CC2)C(=O)CCCN3C4=C(C=C(C=C4)[N+](=O)[O-])OC3=O)C

Isomeric SMILES

CC1=C(C(=CC=C1)N2CCN(CC2)C(=O)CCCN3C4=C(C=C(C=C4)[N+](=O)[O-])OC3=O)C

InChI

InChI=1S/C23H26N4O5/c1-16-5-3-6-19(17(16)2)24-11-13-25(14-12-24)22(28)7-4-10-26-20-9-8-18(27(30)31)15-21(20)32-23(26)29/h3,5-6,8-9,15H,4,7,10-14H2,1-2H3