N-(3,5-dimethoxyphenyl)-4-morpholin-4-ylsulfonyl-2-nitro-aniline

Systemtic Name: N-(3,5-dimethoxyphenyl)-4-morpholin-4-ylsulfonyl-2-nitro-aniline Openeye Name: N-(3,5-dimethoxyphenyl)-4-morpholinosulfonyl-2-nitro-aniline CAS Name: N-(3,5-dimethoxyphenyl)-4-(4-morpholinylsulfonyl)-2-nitroaniline IUPAC Name: N-(3,5-dimethoxyphenyl)-4-morpholin-4-ylsulfonyl-2-nitroaniline Traditional Name: (3,5-dimethoxyphenyl)-(4-morpholinosulfonyl-2-nitro-phenyl)amine Formula: C18H21N3O7S MolecularWeight: 423.44024

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

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