4-[4-cyano-2-(naphthalen-1-ylcarbonylamino)phenyl]butanoic acid

Systemtic Name: 4-[4-cyano-2-(naphthalen-1-ylcarbonylamino)phenyl]butanoic acid Openeye Name: 4-[4-cyano-2-(naphthalene-1-carbonylamino)phenyl]butanoic acid CAS Name: 4-[4-cyano-2-[[1-naphthalenyl(oxo)methyl]amino]phenyl]butanoic acid IUPAC Name: 4-[4-cyano-2-(naphthalene-1-carbonylamino)phenyl]butanoic acid Traditional Name: 4-[4-cyano-2-(1-naphthoylamino)phenyl]butyric acid Formula: C22H18N2O3 MolecularWeight: 358.38992

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)C=CC=C2C(=O)NC3=C(C=CC(=C3)C#N)CCCC(=O)O

Isomeric SMILES

C1=CC=C2C(=C1)C=CC=C2C(=O)NC3=C(C=CC(=C3)C#N)CCCC(=O)O

InChI

InChI=1S/C22H18N2O3/c23-14-15-11-12-17(7-4-10-21(25)26)20(13-15)24-22(27)19-9-3-6-16-5-1-2-8-18(16)19/h1-3,5-6,8-9,11-13H,4,7,10H2,(H,24,27)(H,25,26)