methyl 3-methyl-2-[(4-nitrophenyl)sulfonyl-prop-2-enyl-amino]butanoate

Systemtic Name: methyl 3-methyl-2-[(4-nitrophenyl)sulfonyl-prop-2-enyl-amino]butanoate Openeye Name: methyl 2-[allyl-(4-nitrophenyl)sulfonyl-amino]-3-methyl-butanoate CAS Name: 3-methyl-2-[(4-nitrophenyl)sulfonyl-prop-2-enylamino]butanoic acid methyl ester IUPAC Name: methyl 3-methyl-2-[(4-nitrophenyl)sulfonyl-prop-2-enylamino]butanoate Traditional Name: 2-[allyl(nosyl)amino]-3-methyl-butyric acid methyl ester Formula: C15H20N2O6S MolecularWeight: 356.3941

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C15H20N2O6S/c1-5-10-16(14(11(2)3)15(18)23-4)24(21,22)13-8-6-12(7-9-13)17(19)20/h5-9,11,14H,1,10H2,2-4H3