methyl 3-[(3-methoxy-3-oxidanylidene-propyl)-nitroso-amino]benzoate

Systemtic Name: methyl 3-[(3-methoxy-3-oxidanylidene-propyl)-nitroso-amino]benzoate Openeye Name: methyl 3-[(3-methoxy-3-oxo-propyl)-nitroso-amino]benzoate CAS Name: 3-[(3-methoxy-3-oxopropyl)-nitrosoamino]benzoic acid methyl ester IUPAC Name: methyl 3-[(3-methoxy-3-oxopropyl)-nitrosoamino]benzoate Traditional Name: 3-[(3-keto-3-methoxy-propyl)-nitroso-amino]benzoic acid methyl ester Formula: C12H14N2O5 MolecularWeight: 266.24996

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)CCN(C1=CC=CC(=C1)C(=O)OC)N=O

Isomeric SMILES

COC(=O)CCN(C1=CC=CC(=C1)C(=O)OC)N=O

InChI

InChI=1S/C12H14N2O5/c1-18-11(15)6-7-14(13-17)10-5-3-4-9(8-10)12(16)19-2/h3-5,8H,6-7H2,1-2H3