N-[(E)-(3,5-dimethoxyphenyl)methylideneamino]-2-morpholin-4-ylsulfonyl-4-nitro-aniline

Systemtic Name: N-[(E)-(3,5-dimethoxyphenyl)methylideneamino]-2-morpholin-4-ylsulfonyl-4-nitro-aniline Openeye Name: N-[(E)-(3,5-dimethoxyphenyl)methyleneamino]-2-morpholinosulfonyl-4-nitro-aniline CAS Name: N-[(E)-(3,5-dimethoxyphenyl)methylideneamino]-2-(4-morpholinylsulfonyl)-4-nitroaniline IUPAC Name: N-[(E)-(3,5-dimethoxyphenyl)methylideneamino]-2-morpholin-4-ylsulfonyl-4-nitroaniline Traditional Name: [(E)-(3,5-dimethoxybenzylidene)amino]-(2-morpholinosulfonyl-4-nitro-phenyl)amine Formula: C19H22N4O7S MolecularWeight: 450.46558

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC(=CC(=C1)C=NNC2=C(C=C(C=C2)[N+](=O)[O-])S(=O)(=O)N3CCOCC3)OC

Isomeric SMILES

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

InChI

InChI=1S/C19H22N4O7S/c1-28-16-9-14(10-17(12-16)29-2)13-20-21-18-4-3-15(23(24)25)11-19(18)31(26,27)22-5-7-30-8-6-22/h3-4,9-13,21H,5-8H2,1-2H3/b20-13+