2-(2-ethylhexanoylamino)-3-naphthalen-1-yl-propanoic acid

Systemtic Name: 2-(2-ethylhexanoylamino)-3-naphthalen-1-yl-propanoic acid Openeye Name: 2-(2-ethylhexanoylamino)-3-(1-naphthyl)propanoic acid CAS Name: 2-[(2-ethyl-1-oxohexyl)amino]-3-(1-naphthalenyl)propanoic acid IUPAC Name: 2-(2-ethylhexanoylamino)-3-naphthalen-1-ylpropanoic acid Traditional Name: 2-(2-ethylhexanoylamino)-3-(1-naphthyl)propionic acid Formula: C21H27NO3 MolecularWeight: 341.44398

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC(CC)C(=O)NC(CC1=CC=CC2=CC=CC=C21)C(=O)O

Isomeric SMILES

CCCCC(CC)C(=O)NC(CC1=CC=CC2=CC=CC=C21)C(=O)O

InChI

InChI=1S/C21H27NO3/c1-3-5-9-15(4-2)20(23)22-19(21(24)25)14-17-12-8-11-16-10-6-7-13-18(16)17/h6-8,10-13,15,19H,3-5,9,14H2,1-2H3,(H,22,23)(H,24,25)