5-[[4-(3-methylphenoxy)phenyl]amino]-5-oxidanylidene-pentanoic acid

Systemtic Name: 5-[[4-(3-methylphenoxy)phenyl]amino]-5-oxidanylidene-pentanoic acid Openeye Name: 5-[4-(3-methylphenoxy)anilino]-5-oxo-pentanoic acid CAS Name: 5-[4-(3-methylphenoxy)anilino]-5-oxopentanoic acid IUPAC Name: 5-[4-(3-methylphenoxy)anilino]-5-oxopentanoic acid Traditional Name: 5-keto-5-[4-(3-methylphenoxy)anilino]valeric 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)NC(=O)CCCC(=O)O

Isomeric SMILES

CC1=CC(=CC=C1)OC2=CC=C(C=C2)NC(=O)CCCC(=O)O

InChI

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