N-(2,4-dimethoxyphenyl)-N-[2-[4-(2-methoxyphenyl)piperazin-1-yl]-2-oxidanylidene-ethyl]-2-nitro-benzenesulfonamide

Systemtic Name: N-(2,4-dimethoxyphenyl)-N-[2-[4-(2-methoxyphenyl)piperazin-1-yl]-2-oxidanylidene-ethyl]-2-nitro-benzenesulfonamide Openeye Name: N-(2,4-dimethoxyphenyl)-N-[2-[4-(2-methoxyphenyl)piperazin-1-yl]-2-oxo-ethyl]-2-nitro-benzenesulfonamide CAS Name: N-(2,4-dimethoxyphenyl)-N-[2-[4-(2-methoxyphenyl)-1-piperazinyl]-2-oxoethyl]-2-nitrobenzenesulfonamide IUPAC Name: N-(2,4-dimethoxyphenyl)-N-[2-[4-(2-methoxyphenyl)piperazin-1-yl]-2-oxoethyl]-2-nitrobenzenesulfonamide Traditional Name: N-(2,4-dimethoxyphenyl)-N-[2-keto-2-[4-(2-methoxyphenyl)piperazino]ethyl]-2-nitro-benzenesulfonamide Formula: C27H30N4O8S MolecularWeight: 570.6141

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC(=C(C=C1)N(CC(=O)N2CCN(CC2)C3=CC=CC=C3OC)S(=O)(=O)C4=CC=CC=C4[N+](=O)[O-])OC

Isomeric SMILES

COC1=CC(=C(C=C1)N(CC(=O)N2CCN(CC2)C3=CC=CC=C3OC)S(=O)(=O)C4=CC=CC=C4[N+](=O)[O-])OC

InChI

InChI=1S/C27H30N4O8S/c1-37-20-12-13-22(25(18-20)39-3)30(40(35,36)26-11-7-5-9-23(26)31(33)34)19-27(32)29-16-14-28(15-17-29)21-8-4-6-10-24(21)38-2/h4-13,18H,14-17,19H2,1-3H3