methyl 3-[(3-methylphenyl)-nitroso-amino]propanoate

Systemtic Name: methyl 3-[(3-methylphenyl)-nitroso-amino]propanoate Openeye Name: methyl 3-(3-methyl-N-nitroso-anilino)propanoate CAS Name: 3-(3-methyl-N-nitrosoanilino)propanoic acid methyl ester IUPAC Name: methyl 3-(3-methyl-N-nitrosoanilino)propanoate Traditional Name: 3-(3-methyl-N-nitroso-anilino)propionic acid methyl ester Formula: C11H14N2O3 MolecularWeight: 222.24046

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC=C1)N(CCC(=O)OC)N=O

Isomeric SMILES

CC1=CC(=CC=C1)N(CCC(=O)OC)N=O

InChI

InChI=1S/C11H14N2O3/c1-9-4-3-5-10(8-9)13(12-15)7-6-11(14)16-2/h3-5,8H,6-7H2,1-2H3