N-(4-ethoxy-2-nitro-phenyl)-3-[3-[(4-ethoxy-2-nitro-phenyl)amino]-3-oxidanylidene-propyl]sulfanyl-propanamide

Systemtic Name: N-(4-ethoxy-2-nitro-phenyl)-3-[3-[(4-ethoxy-2-nitro-phenyl)amino]-3-oxidanylidene-propyl]sulfanyl-propanamide Openeye Name: 3-[3-(4-ethoxy-2-nitro-anilino)-3-oxo-propyl]sulfanyl-N-(4-ethoxy-2-nitro-phenyl)propanamide CAS Name: 3-[[3-(4-ethoxy-2-nitroanilino)-3-oxopropyl]thio]-N-(4-ethoxy-2-nitrophenyl)propanamide IUPAC Name: 3-[3-(4-ethoxy-2-nitroanilino)-3-oxopropyl]sulfanyl-N-(4-ethoxy-2-nitrophenyl)propanamide Traditional Name: 3-[[3-(4-ethoxy-2-nitro-anilino)-3-keto-propyl]thio]-N-(4-ethoxy-2-nitro-phenyl)propionamide Formula: C22H26N4O8S MolecularWeight: 506.52884

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=CC(=C(C=C1)NC(=O)CCSCCC(=O)NC2=C(C=C(C=C2)OCC)[N+](=O)[O-])[N+](=O)[O-]

Isomeric SMILES

CCOC1=CC(=C(C=C1)NC(=O)CCSCCC(=O)NC2=C(C=C(C=C2)OCC)[N+](=O)[O-])[N+](=O)[O-]

InChI

InChI=1S/C22H26N4O8S/c1-3-33-15-5-7-17(19(13-15)25(29)30)23-21(27)9-11-35-12-10-22(28)24-18-8-6-16(34-4-2)14-20(18)26(31)32/h5-8,13-14H,3-4,9-12H2,1-2H3,(H,23,27)(H,24,28)