N-(2,4-dimethylphenyl)-3-[(4-methoxy-3-nitro-phenyl)sulfonylamino]propanamide

Systemtic Name: N-(2,4-dimethylphenyl)-3-[(4-methoxy-3-nitro-phenyl)sulfonylamino]propanamide Openeye Name: N-(2,4-dimethylphenyl)-3-[(4-methoxy-3-nitro-phenyl)sulfonylamino]propanamide CAS Name: N-(2,4-dimethylphenyl)-3-[(4-methoxy-3-nitrophenyl)sulfonylamino]propanamide IUPAC Name: N-(2,4-dimethylphenyl)-3-[(4-methoxy-3-nitrophenyl)sulfonylamino]propanamide Traditional Name: N-(2,4-dimethylphenyl)-3-[(4-methoxy-3-nitro-phenyl)sulfonylamino]propionamide Formula: C18H21N3O6S MolecularWeight: 407.44084

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1)NC(=O)CCNS(=O)(=O)C2=CC(=C(C=C2)OC)[N+](=O)[O-])C

Isomeric SMILES

CC1=CC(=C(C=C1)NC(=O)CCNS(=O)(=O)C2=CC(=C(C=C2)OC)[N+](=O)[O-])C

InChI

InChI=1S/C18H21N3O6S/c1-12-4-6-15(13(2)10-12)20-18(22)8-9-19-28(25,26)14-5-7-17(27-3)16(11-14)21(23)24/h4-7,10-11,19H,8-9H2,1-3H3,(H,20,22)