4-(cyclopropylamino)-N-(3-morpholin-4-ylsulfonylphenyl)-3-nitro-benzamide

Systemtic Name: 4-(cyclopropylamino)-N-(3-morpholin-4-ylsulfonylphenyl)-3-nitro-benzamide Openeye Name: 4-(cyclopropylamino)-N-(3-morpholinosulfonylphenyl)-3-nitro-benzamide CAS Name: 4-(cyclopropylamino)-N-[3-(4-morpholinylsulfonyl)phenyl]-3-nitrobenzamide IUPAC Name: 4-(cyclopropylamino)-N-(3-morpholin-4-ylsulfonylphenyl)-3-nitrobenzamide Traditional Name: 4-(cyclopropylamino)-N-(3-morpholinosulfonylphenyl)-3-nitro-benzamide Formula: C20H22N4O6S MolecularWeight: 446.47688

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Descriptors Computed from Structure

Canonical SMILES:

C1CC1NC2=C(C=C(C=C2)C(=O)NC3=CC(=CC=C3)S(=O)(=O)N4CCOCC4)[N+](=O)[O-]

Isomeric SMILES

C1CC1NC2=C(C=C(C=C2)C(=O)NC3=CC(=CC=C3)S(=O)(=O)N4CCOCC4)[N+](=O)[O-]

InChI

InChI=1S/C20H22N4O6S/c25-20(14-4-7-18(21-15-5-6-15)19(12-14)24(26)27)22-16-2-1-3-17(13-16)31(28,29)23-8-10-30-11-9-23/h1-4,7,12-13,15,21H,5-6,8-11H2,(H,22,25)