N-[4-[methylsulfonyl(prop-2-enyl)amino]-5-nitro-2-phenylmethoxy-phenyl]ethanamide

Systemtic Name: N-[4-[methylsulfonyl(prop-2-enyl)amino]-5-nitro-2-phenylmethoxy-phenyl]ethanamide Openeye Name: N-[4-[allyl(methylsulfonyl)amino]-2-benzyloxy-5-nitro-phenyl]acetamide CAS Name: N-[4-[methylsulfonyl(prop-2-enyl)amino]-5-nitro-2-phenylmethoxyphenyl]acetamide IUPAC Name: N-[4-[methylsulfonyl(prop-2-enyl)amino]-5-nitro-2-phenylmethoxyphenyl]acetamide Traditional Name: N-[4-[allyl(mesyl)amino]-2-benzoxy-5-nitro-phenyl]acetamide Formula: C19H21N3O6S MolecularWeight: 419.45154

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(=O)NC1=CC(=C(C=C1OCC2=CC=CC=C2)N(CC=C)S(=O)(=O)C)[N+](=O)[O-]

Isomeric SMILES

CC(=O)NC1=CC(=C(C=C1OCC2=CC=CC=C2)N(CC=C)S(=O)(=O)C)[N+](=O)[O-]

InChI

InChI=1S/C19H21N3O6S/c1-4-10-21(29(3,26)27)17-12-19(28-13-15-8-6-5-7-9-15)16(20-14(2)23)11-18(17)22(24)25/h4-9,11-12H,1,10,13H2,2-3H3,(H,20,23)