3,4-dimethoxy-N-(4-morpholin-4-ylsulfonyl-2-nitro-phenyl)aniline

Systemtic Name: 3,4-dimethoxy-N-(4-morpholin-4-ylsulfonyl-2-nitro-phenyl)aniline Openeye Name: 3,4-dimethoxy-N-(4-morpholinosulfonyl-2-nitro-phenyl)aniline CAS Name: 3,4-dimethoxy-N-[4-(4-morpholinylsulfonyl)-2-nitrophenyl]aniline IUPAC Name: 3,4-dimethoxy-N-(4-morpholin-4-ylsulfonyl-2-nitrophenyl)aniline Traditional Name: (3,4-dimethoxyphenyl)-(4-morpholinosulfonyl-2-nitro-phenyl)amine Formula: C18H21N3O7S MolecularWeight: 423.44024

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)NC2=C(C=C(C=C2)S(=O)(=O)N3CCOCC3)[N+](=O)[O-])OC

Isomeric SMILES

COC1=C(C=C(C=C1)NC2=C(C=C(C=C2)S(=O)(=O)N3CCOCC3)[N+](=O)[O-])OC

InChI

InChI=1S/C18H21N3O7S/c1-26-17-6-3-13(11-18(17)27-2)19-15-5-4-14(12-16(15)21(22)23)29(24,25)20-7-9-28-10-8-20/h3-6,11-12,19H,7-10H2,1-2H3