3-[[4-[1-(6-thiophen-3-ylnaphthalen-2-yl)butyl]phenyl]carbonylamino]propanoic acid

Systemtic Name: 3-[[4-[1-(6-thiophen-3-ylnaphthalen-2-yl)butyl]phenyl]carbonylamino]propanoic acid Openeye Name: 3-[[4-[1-[6-(3-thienyl)-2-naphthyl]butyl]benzoyl]amino]propanoic acid CAS Name: 3-[[oxo-[4-[1-[6-(3-thiophenyl)-2-naphthalenyl]butyl]phenyl]methyl]amino]propanoic acid IUPAC Name: 3-[[4-[1-(6-thiophen-3-ylnaphthalen-2-yl)butyl]benzoyl]amino]propanoic acid Traditional Name: 3-[[4-[1-[6-(3-thienyl)-2-naphthyl]butyl]benzoyl]amino]propionic acid Formula: C28H27NO3S MolecularWeight: 457.58388

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Descriptors Computed from Structure

Canonical SMILES:

CCCC(C1=CC=C(C=C1)C(=O)NCCC(=O)O)C2=CC3=C(C=C2)C=C(C=C3)C4=CSC=C4

Isomeric SMILES

CCCC(C1=CC=C(C=C1)C(=O)NCCC(=O)O)C2=CC3=C(C=C2)C=C(C=C3)C4=CSC=C4

InChI

InChI=1S/C28H27NO3S/c1-2-3-26(19-4-6-20(7-5-19)28(32)29-14-12-27(30)31)24-11-10-21-16-23(9-8-22(21)17-24)25-13-15-33-18-25/h4-11,13,15-18,26H,2-3,12,14H2,1H3,(H,29,32)(H,30,31)