4-[4-[[5-(aminomethyl)-2-oxidanyl-phenyl]carbonylamino]phenyl]butanoic acid

Systemtic Name: 4-[4-[[5-(aminomethyl)-2-oxidanyl-phenyl]carbonylamino]phenyl]butanoic acid Openeye Name: 4-[4-[[5-(aminomethyl)-2-hydroxy-benzoyl]amino]phenyl]butanoic acid CAS Name: 4-[4-[[[5-(aminomethyl)-2-hydroxyphenyl]-oxomethyl]amino]phenyl]butanoic acid IUPAC Name: 4-[4-[[5-(aminomethyl)-2-hydroxybenzoyl]amino]phenyl]butanoic acid Traditional Name: 4-[4-[[5-(aminomethyl)-2-hydroxy-benzoyl]amino]phenyl]butyric acid Formula: C18H20N2O4 MolecularWeight: 328.3624

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC=C1CCCC(=O)O)NC(=O)C2=C(C=CC(=C2)CN)O

Isomeric SMILES

C1=CC(=CC=C1CCCC(=O)O)NC(=O)C2=C(C=CC(=C2)CN)O

InChI

InChI=1S/C18H20N2O4/c19-11-13-6-9-16(21)15(10-13)18(24)20-14-7-4-12(5-8-14)2-1-3-17(22)23/h4-10,21H,1-3,11,19H2,(H,20,24)(H,22,23)