methyl 2-azanyl-2-(4-chlorophenyl)-4-nitroso-3-(oxidanylamino)-4-phenyl-but-3-enoate

Systemtic Name: methyl 2-azanyl-2-(4-chlorophenyl)-4-nitroso-3-(oxidanylamino)-4-phenyl-but-3-enoate Openeye Name: methyl 2-amino-2-(4-chlorophenyl)-3-(hydroxyamino)-4-nitroso-4-phenyl-but-3-enoate CAS Name: 2-amino-2-(4-chlorophenyl)-3-(hydroxyamino)-4-nitroso-4-phenyl-3-butenoic acid methyl ester IUPAC Name: methyl 2-amino-2-(4-chlorophenyl)-3-(hydroxyamino)-4-nitroso-4-phenylbut-3-enoate Traditional Name: 2-amino-2-(4-chlorophenyl)-3-(hydroxyamino)-4-nitroso-4-phenyl-but-3-enoic acid methyl ester Formula: C17H16ClN3O4 MolecularWeight: 361.77964

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C(C1=CC=C(C=C1)Cl)(C(=C(C2=CC=CC=C2)N=O)NO)N

Isomeric SMILES

COC(=O)C(C1=CC=C(C=C1)Cl)(C(=C(C2=CC=CC=C2)N=O)NO)N

InChI

InChI=1S/C17H16ClN3O4/c1-25-16(22)17(19,12-7-9-13(18)10-8-12)15(21-24)14(20-23)11-5-3-2-4-6-11/h2-10,21,24H,19H2,1H3