1-[4-[(3-morpholin-4-ylsulfonylphenyl)amino]-3-nitro-phenyl]ethanone

Systemtic Name: 1-[4-[(3-morpholin-4-ylsulfonylphenyl)amino]-3-nitro-phenyl]ethanone Openeye Name: 1-[4-(3-morpholinosulfonylanilino)-3-nitro-phenyl]ethanone CAS Name: 1-[4-[3-(4-morpholinylsulfonyl)anilino]-3-nitrophenyl]ethanone IUPAC Name: 1-[4-(3-morpholin-4-ylsulfonylanilino)-3-nitrophenyl]ethanone Traditional Name: 1-[4-(3-morpholinosulfonylanilino)-3-nitro-phenyl]ethanone Formula: C18H19N3O6S MolecularWeight: 405.42496

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)C1=CC(=C(C=C1)NC2=CC(=CC=C2)S(=O)(=O)N3CCOCC3)[N+](=O)[O-]

Isomeric SMILES

CC(=O)C1=CC(=C(C=C1)NC2=CC(=CC=C2)S(=O)(=O)N3CCOCC3)[N+](=O)[O-]

InChI

InChI=1S/C18H19N3O6S/c1-13(22)14-5-6-17(18(11-14)21(23)24)19-15-3-2-4-16(12-15)28(25,26)20-7-9-27-10-8-20/h2-6,11-12,19H,7-10H2,1H3