N-[(E)-[morpholin-4-yl(phenylsulfonyl)methylidene]amino]-3-nitro-aniline

Systemtic Name: N-[(E)-[morpholin-4-yl(phenylsulfonyl)methylidene]amino]-3-nitro-aniline Openeye Name: N-[(E)-[benzenesulfonyl(morpholino)methylene]amino]-3-nitro-aniline CAS Name: N-[(E)-[benzenesulfonyl(4-morpholinyl)methylidene]amino]-3-nitroaniline IUPAC Name: N-[(E)-[benzenesulfonyl(morpholin-4-yl)methylidene]amino]-3-nitroaniline Traditional Name: [(E)-[besyl(morpholino)methylene]amino]-(3-nitrophenyl)amine Formula: C17H18N4O5S MolecularWeight: 390.41362

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Descriptors Computed from Structure

Canonical SMILES:

C1COCCN1C(=NNC2=CC(=CC=C2)[N+](=O)[O-])S(=O)(=O)C3=CC=CC=C3

Isomeric SMILES

C1COCCN1/C(=N\NC2=CC(=CC=C2)[N+](=O)[O-])/S(=O)(=O)C3=CC=CC=C3

InChI

InChI=1S/C17H18N4O5S/c22-21(23)15-6-4-5-14(13-15)18-19-17(20-9-11-26-12-10-20)27(24,25)16-7-2-1-3-8-16/h1-8,13,18H,9-12H2/b19-17+