N-methyl-N-[1-(3-nitrophenyl)ethyl]-3-[(2-nitro-4-sulfamoyl-phenyl)amino]propanamide

Systemtic Name: N-methyl-N-[1-(3-nitrophenyl)ethyl]-3-[(2-nitro-4-sulfamoyl-phenyl)amino]propanamide Openeye Name: N-methyl-N-[1-(3-nitrophenyl)ethyl]-3-(2-nitro-4-sulfamoyl-anilino)propanamide CAS Name: N-methyl-N-[1-(3-nitrophenyl)ethyl]-3-(2-nitro-4-sulfamoylanilino)propanamide IUPAC Name: N-methyl-N-[1-(3-nitrophenyl)ethyl]-3-(2-nitro-4-sulfamoylanilino)propanamide Traditional Name: N-methyl-N-[1-(3-nitrophenyl)ethyl]-3-(2-nitro-4-sulfamoyl-anilino)propionamide Formula: C18H21N5O7S MolecularWeight: 451.45364

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Descriptors Computed from Structure

Canonical SMILES:

CC(C1=CC(=CC=C1)[N+](=O)[O-])N(C)C(=O)CCNC2=C(C=C(C=C2)S(=O)(=O)N)[N+](=O)[O-]

Isomeric SMILES

CC(C1=CC(=CC=C1)[N+](=O)[O-])N(C)C(=O)CCNC2=C(C=C(C=C2)S(=O)(=O)N)[N+](=O)[O-]

InChI

InChI=1S/C18H21N5O7S/c1-12(13-4-3-5-14(10-13)22(25)26)21(2)18(24)8-9-20-16-7-6-15(31(19,29)30)11-17(16)23(27)28/h3-7,10-12,20H,8-9H2,1-2H3,(H2,19,29,30)