2-[3-(aminomethyl)phenoxy]-4-oxidanylidene-4-[phenyl-(phenylmethyl)amino]butanoic acid

Systemtic Name: 2-[3-(aminomethyl)phenoxy]-4-oxidanylidene-4-[phenyl-(phenylmethyl)amino]butanoic acid Openeye Name: 2-[3-(aminomethyl)phenoxy]-4-(N-benzylanilino)-4-oxo-butanoic acid CAS Name: 2-[3-(aminomethyl)phenoxy]-4-oxo-4-(N-(phenylmethyl)anilino)butanoic acid IUPAC Name: 2-[3-(aminomethyl)phenoxy]-4-(N-benzylanilino)-4-oxobutanoic acid Traditional Name: 2-[3-(aminomethyl)phenoxy]-4-(N-benzylanilino)-4-keto-butyric acid Formula: C24H24N2O4 MolecularWeight: 404.45836

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)CN(C2=CC=CC=C2)C(=O)CC(C(=O)O)OC3=CC=CC(=C3)CN

Isomeric SMILES

C1=CC=C(C=C1)CN(C2=CC=CC=C2)C(=O)CC(C(=O)O)OC3=CC=CC(=C3)CN

InChI

InChI=1S/C24H24N2O4/c25-16-19-10-7-13-21(14-19)30-22(24(28)29)15-23(27)26(20-11-5-2-6-12-20)17-18-8-3-1-4-9-18/h1-14,22H,15-17,25H2,(H,28,29)