N-butyl-2-[2-[(2,4-dimethoxyphenyl)-(2-nitrophenyl)sulfonyl-amino]ethanoylamino]benzamide

Systemtic Name: N-butyl-2-[2-[(2,4-dimethoxyphenyl)-(2-nitrophenyl)sulfonyl-amino]ethanoylamino]benzamide Openeye Name: N-butyl-2-[[2-(2,4-dimethoxy-N-(2-nitrophenyl)sulfonyl-anilino)acetyl]amino]benzamide CAS Name: N-butyl-2-[[2-(2,4-dimethoxy-N-(2-nitrophenyl)sulfonylanilino)-1-oxoethyl]amino]benzamide IUPAC Name: N-butyl-2-[[2-(2,4-dimethoxy-N-(2-nitrophenyl)sulfonylanilino)acetyl]amino]benzamide Traditional Name: N-butyl-2-[[2-(2,4-dimethoxy-N-(2-nitrophenyl)sulfonyl-anilino)acetyl]amino]benzamide Formula: C27H30N4O8S MolecularWeight: 570.6141

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Descriptors Computed from Structure

Canonical SMILES:

CCCCNC(=O)C1=CC=CC=C1NC(=O)CN(C2=C(C=C(C=C2)OC)OC)S(=O)(=O)C3=CC=CC=C3[N+](=O)[O-]

Isomeric SMILES

CCCCNC(=O)C1=CC=CC=C1NC(=O)CN(C2=C(C=C(C=C2)OC)OC)S(=O)(=O)C3=CC=CC=C3[N+](=O)[O-]

InChI

InChI=1S/C27H30N4O8S/c1-4-5-16-28-27(33)20-10-6-7-11-21(20)29-26(32)18-30(22-15-14-19(38-2)17-24(22)39-3)40(36,37)25-13-9-8-12-23(25)31(34)35/h6-15,17H,4-5,16,18H2,1-3H3,(H,28,33)(H,29,32)