4-[4-[(2-methylphenyl)carbamoylamino]phenyl]butanoic acid

Systemtic Name: 4-[4-[(2-methylphenyl)carbamoylamino]phenyl]butanoic acid Openeye Name: 4-[4-(o-tolylcarbamoylamino)phenyl]butanoic acid CAS Name: 4-[4-[[(2-methylanilino)-oxomethyl]amino]phenyl]butanoic acid IUPAC Name: 4-[4-[(2-methylphenyl)carbamoylamino]phenyl]butanoic acid Traditional Name: 4-[4-(o-tolylcarbamoylamino)phenyl]butyric acid Formula: C18H20N2O3 MolecularWeight: 312.363

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC=C1NC(=O)NC2=CC=C(C=C2)CCCC(=O)O

Isomeric SMILES

CC1=CC=CC=C1NC(=O)NC2=CC=C(C=C2)CCCC(=O)O

InChI

InChI=1S/C18H20N2O3/c1-13-5-2-3-7-16(13)20-18(23)19-15-11-9-14(10-12-15)6-4-8-17(21)22/h2-3,5,7,9-12H,4,6,8H2,1H3,(H,21,22)(H2,19,20,23)