4-[(5-cyano-1-phenyl-pentoxy)amino]-4-oxidanylidene-butanoic acid

Systemtic Name: 4-[(5-cyano-1-phenyl-pentoxy)amino]-4-oxidanylidene-butanoic acid Openeye Name: 4-[(5-cyano-1-phenyl-pentoxy)amino]-4-oxo-butanoic acid CAS Name: 4-[(5-cyano-1-phenylpentoxy)amino]-4-oxobutanoic acid IUPAC Name: 4-[(5-cyano-1-phenylpentoxy)amino]-4-oxobutanoic acid Traditional Name: 4-[(5-cyano-1-phenyl-pentoxy)amino]-4-keto-butyric acid Formula: C16H20N2O4 MolecularWeight: 304.341

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)C(CCCCC#N)ONC(=O)CCC(=O)O

Isomeric SMILES

C1=CC=C(C=C1)C(CCCCC#N)ONC(=O)CCC(=O)O

InChI

InChI=1S/C16H20N2O4/c17-12-6-2-5-9-14(13-7-3-1-4-8-13)22-18-15(19)10-11-16(20)21/h1,3-4,7-8,14H,2,5-6,9-11H2,(H,18,19)(H,20,21)