ethyl 3-azanyl-3-oxidanylidene-propanoate; (4-methylsulfonyl-2-nitro-phenyl)diazane

Systemtic Name: ethyl 3-azanyl-3-oxidanylidene-propanoate; (4-methylsulfonyl-2-nitro-phenyl)diazane Openeye Name: ethyl 3-amino-3-oxo-propanoate; (4-methylsulfonyl-2-nitro-phenyl)hydrazine CAS Name: 3-amino-3-oxopropanoic acid ethyl ester; (4-methylsulfonyl-2-nitrophenyl)hydrazine IUPAC Name: ethyl 3-amino-3-oxopropanoate; (4-methylsulfonyl-2-nitrophenyl)hydrazine Traditional Name: 3-amino-3-keto-propionic acid ethyl ester; (4-mesyl-2-nitro-phenyl)hydrazine Formula: C12H18N4O7S MolecularWeight: 362.35892

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)CC(=O)N.CS(=O)(=O)C1=CC(=C(C=C1)NN)[N+](=O)[O-]

Isomeric SMILES

CCOC(=O)CC(=O)N.CS(=O)(=O)C1=CC(=C(C=C1)NN)[N+](=O)[O-]

InChI

InChI=1S/C7H9N3O4S.C5H9NO3/c1-15(13,14)5-2-3-6(9-8)7(4-5)10(11)12;1-2-9-5(8)3-4(6)7/h2-4,9H,8H2,1H3;2-3H2,1H3,(H2,6,7)