5-[(3-methoxyphenyl)methylamino]-5-oxidanylidene-pentanoic acid

Systemtic Name: 5-[(3-methoxyphenyl)methylamino]-5-oxidanylidene-pentanoic acid Openeye Name: 5-[(3-methoxyphenyl)methylamino]-5-oxo-pentanoic acid CAS Name: 5-[(3-methoxyphenyl)methylamino]-5-oxopentanoic acid IUPAC Name: 5-[(3-methoxyphenyl)methylamino]-5-oxopentanoic acid Traditional Name: 5-keto-5-(m-anisylamino)valeric acid Formula: C13H17NO4 MolecularWeight: 251.27838

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=CC(=C1)CNC(=O)CCCC(=O)O

Isomeric SMILES

COC1=CC=CC(=C1)CNC(=O)CCCC(=O)O

InChI

InChI=1S/C13H17NO4/c1-18-11-5-2-4-10(8-11)9-14-12(15)6-3-7-13(16)17/h2,4-5,8H,3,6-7,9H2,1H3,(H,14,15)(H,16,17)