4-[[4-(3-methylphenoxy)phenyl]methylamino]-4-oxidanylidene-butanoic acid

Systemtic Name: 4-[[4-(3-methylphenoxy)phenyl]methylamino]-4-oxidanylidene-butanoic acid Openeye Name: 4-[[4-(3-methylphenoxy)phenyl]methylamino]-4-oxo-butanoic acid CAS Name: 4-[[4-(3-methylphenoxy)phenyl]methylamino]-4-oxobutanoic acid IUPAC Name: 4-[[4-(3-methylphenoxy)phenyl]methylamino]-4-oxobutanoic acid Traditional Name: 4-keto-4-[[4-(3-methylphenoxy)benzyl]amino]butyric acid Formula: C18H19NO4 MolecularWeight: 313.34776

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC=C1)OC2=CC=C(C=C2)CNC(=O)CCC(=O)O

Isomeric SMILES

CC1=CC(=CC=C1)OC2=CC=C(C=C2)CNC(=O)CCC(=O)O

InChI

InChI=1S/C18H19NO4/c1-13-3-2-4-16(11-13)23-15-7-5-14(6-8-15)12-19-17(20)9-10-18(21)22/h2-8,11H,9-10,12H2,1H3,(H,19,20)(H,21,22)