(4-nitrophenyl)methyl N-[3-[2-(2-dimethylaminoethylamino)-2-oxidanylidene-ethyl]-4-methylsulfonyl-phenyl]-N-methyl-carbamate

Systemtic Name: (4-nitrophenyl)methyl N-[3-[2-(2-dimethylaminoethylamino)-2-oxidanylidene-ethyl]-4-methylsulfonyl-phenyl]-N-methyl-carbamate Openeye Name: (4-nitrophenyl)methyl N-[3-[2-(2-dimethylaminoethylamino)-2-oxo-ethyl]-4-methylsulfonyl-phenyl]-N-methyl-carbamate CAS Name: N-[3-[2-(2-dimethylaminoethylamino)-2-oxoethyl]-4-methylsulfonylphenyl]-N-methylcarbamic acid (4-nitrophenyl)methyl ester IUPAC Name: (4-nitrophenyl)methyl N-[3-[2-(2-dimethylaminoethylamino)-2-oxoethyl]-4-methylsulfonylphenyl]-N-methylcarbamate Traditional Name: N-[3-[2-(2-dimethylaminoethylamino)-2-keto-ethyl]-4-mesyl-phenyl]-N-methyl-carbamic acid (4-nitrobenzyl) ester Formula: C22H28N4O7S MolecularWeight: 492.54532

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Descriptors Computed from Structure

Canonical SMILES:

CN(C)CCNC(=O)CC1=C(C=CC(=C1)N(C)C(=O)OCC2=CC=C(C=C2)[N+](=O)[O-])S(=O)(=O)C

Isomeric SMILES

CN(C)CCNC(=O)CC1=C(C=CC(=C1)N(C)C(=O)OCC2=CC=C(C=C2)[N+](=O)[O-])S(=O)(=O)C

InChI

InChI=1S/C22H28N4O7S/c1-24(2)12-11-23-21(27)14-17-13-19(9-10-20(17)34(4,31)32)25(3)22(28)33-15-16-5-7-18(8-6-16)26(29)30/h5-10,13H,11-12,14-15H2,1-4H3,(H,23,27)