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

Systemtic Name: N-[2-methoxy-4-[methylsulfonyl(prop-2-enyl)amino]-5-nitro-phenyl]ethanamide Openeye Name: N-[4-[allyl(methylsulfonyl)amino]-2-methoxy-5-nitro-phenyl]acetamide CAS Name: N-[2-methoxy-4-[methylsulfonyl(prop-2-enyl)amino]-5-nitrophenyl]acetamide IUPAC Name: N-[2-methoxy-4-[methylsulfonyl(prop-2-enyl)amino]-5-nitrophenyl]acetamide Traditional Name: N-[4-[allyl(mesyl)amino]-2-methoxy-5-nitro-phenyl]acetamide Formula: C13H17N3O6S MolecularWeight: 343.35558

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)NC1=CC(=C(C=C1OC)N(CC=C)S(=O)(=O)C)[N+](=O)[O-]

Isomeric SMILES

CC(=O)NC1=CC(=C(C=C1OC)N(CC=C)S(=O)(=O)C)[N+](=O)[O-]

InChI

InChI=1S/C13H17N3O6S/c1-5-6-15(23(4,20)21)11-8-13(22-3)10(14-9(2)17)7-12(11)16(18)19/h5,7-8H,1,6H2,2-4H3,(H,14,17)