methyl 3-[(3-methoxy-3-oxidanylidene-propyl)amino]propanoate; 3-phenylpropanenitrile

Systemtic Name: methyl 3-[(3-methoxy-3-oxidanylidene-propyl)amino]propanoate; 3-phenylpropanenitrile Openeye Name: methyl 3-[(3-methoxy-3-oxo-propyl)amino]propanoate; 3-phenylpropanenitrile CAS Name: 3-[(3-methoxy-3-oxopropyl)amino]propanoic acid methyl ester; 3-phenylpropanenitrile IUPAC Name: methyl 3-[(3-methoxy-3-oxopropyl)amino]propanoate; 3-phenylpropanenitrile Traditional Name: 3-[(3-keto-3-methoxy-propyl)amino]propionic acid methyl ester; 3-phenylpropionitrile Formula: C17H24N2O4 MolecularWeight: 320.38346

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)CCNCCC(=O)OC.C1=CC=C(C=C1)CCC#N

Isomeric SMILES

COC(=O)CCNCCC(=O)OC.C1=CC=C(C=C1)CCC#N

InChI

InChI=1S/C9H9N.C8H15NO4/c10-8-4-7-9-5-2-1-3-6-9;1-12-7(10)3-5-9-6-4-8(11)13-2/h1-3,5-6H,4,7H2;9H,3-6H2,1-2H3