N-[2-[4-(3-methylphenyl)piperazin-1-yl]ethyl]-4-(6-nitro-2-oxidanylidene-1,3-benzoxazol-3-yl)butanamide

Systemtic Name: N-[2-[4-(3-methylphenyl)piperazin-1-yl]ethyl]-4-(6-nitro-2-oxidanylidene-1,3-benzoxazol-3-yl)butanamide Openeye Name: N-[2-[4-(m-tolyl)piperazin-1-yl]ethyl]-4-(6-nitro-2-oxo-1,3-benzoxazol-3-yl)butanamide CAS Name: N-[2-[4-(3-methylphenyl)-1-piperazinyl]ethyl]-4-(6-nitro-2-oxo-1,3-benzoxazol-3-yl)butanamide IUPAC Name: N-[2-[4-(3-methylphenyl)piperazin-1-yl]ethyl]-4-(6-nitro-2-oxo-1,3-benzoxazol-3-yl)butanamide Traditional Name: 4-(2-keto-6-nitro-1,3-benzoxazol-3-yl)-N-[2-[4-(m-tolyl)piperazino]ethyl]butyramide Formula: C24H29N5O5 MolecularWeight: 467.51756

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C24H29N5O5/c1-18-4-2-5-19(16-18)27-14-12-26(13-15-27)11-9-25-23(30)6-3-10-28-21-8-7-20(29(32)33)17-22(21)34-24(28)31/h2,4-5,7-8,16-17H,3,6,9-15H2,1H3,(H,25,30)