N1-(1-cyclopropylethyl)-N1-[(4-methoxyphenyl)methyl]-N4,N4-dimethyl-2-nitro-benzene-1,4-disulfonamide

Systemtic Name: N1-(1-cyclopropylethyl)-N1-[(4-methoxyphenyl)methyl]-N4,N4-dimethyl-2-nitro-benzene-1,4-disulfonamide Openeye Name: N1-(1-cyclopropylethyl)-N1-[(4-methoxyphenyl)methyl]-N4,N4-dimethyl-2-nitro-benzene-1,4-disulfonamide CAS Name: N1-(1-cyclopropylethyl)-N1-[(4-methoxyphenyl)methyl]-N4,N4-dimethyl-2-nitrobenzene-1,4-disulfonamide IUPAC Name: 1-N-(1-cyclopropylethyl)-1-N-[(4-methoxyphenyl)methyl]-4-N,4-N-dimethyl-2-nitrobenzene-1,4-disulfonamide Traditional Name: N-(1-cyclopropylethyl)-N',N'-dimethyl-2-nitro-N-p-anisyl-benzene-1,4-disulfonamide Formula: C21H27N3O7S2 MolecularWeight: 497.58498

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Descriptors Computed from Structure

Canonical SMILES:

CC(C1CC1)N(CC2=CC=C(C=C2)OC)S(=O)(=O)C3=C(C=C(C=C3)S(=O)(=O)N(C)C)[N+](=O)[O-]

Isomeric SMILES

CC(C1CC1)N(CC2=CC=C(C=C2)OC)S(=O)(=O)C3=C(C=C(C=C3)S(=O)(=O)N(C)C)[N+](=O)[O-]

InChI

InChI=1S/C21H27N3O7S2/c1-15(17-7-8-17)23(14-16-5-9-18(31-4)10-6-16)33(29,30)21-12-11-19(13-20(21)24(25)26)32(27,28)22(2)3/h5-6,9-13,15,17H,7-8,14H2,1-4H3