4-oxidanylidene-4-[2-(2-pentoxynaphthalen-1-yl)ethylamino]butanoic acid

Systemtic Name: 4-oxidanylidene-4-[2-(2-pentoxynaphthalen-1-yl)ethylamino]butanoic acid Openeye Name: 4-oxo-4-[2-(2-pentoxy-1-naphthyl)ethylamino]butanoic acid CAS Name: 4-oxo-4-[2-(2-pentoxy-1-naphthalenyl)ethylamino]butanoic acid IUPAC Name: 4-oxo-4-[2-(2-pentoxynaphthalen-1-yl)ethylamino]butanoic acid Traditional Name: 4-[2-(2-amoxy-1-naphthyl)ethylamino]-4-keto-butyric acid Formula: C21H27NO4 MolecularWeight: 357.44338

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCOC1=C(C2=CC=CC=C2C=C1)CCNC(=O)CCC(=O)O

Isomeric SMILES

CCCCCOC1=C(C2=CC=CC=C2C=C1)CCNC(=O)CCC(=O)O

InChI

InChI=1S/C21H27NO4/c1-2-3-6-15-26-19-10-9-16-7-4-5-8-17(16)18(19)13-14-22-20(23)11-12-21(24)25/h4-5,7-10H,2-3,6,11-15H2,1H3,(H,22,23)(H,24,25)