3-[[4-(3-methyl-6-oxidanyl-2-phenyl-naphthalen-1-yl)oxyphenyl]amino]-3-oxidanylidene-propanoic acid

Systemtic Name: 3-[[4-(3-methyl-6-oxidanyl-2-phenyl-naphthalen-1-yl)oxyphenyl]amino]-3-oxidanylidene-propanoic acid Openeye Name: 3-[4-[(6-hydroxy-3-methyl-2-phenyl-1-naphthyl)oxy]anilino]-3-oxo-propanoic acid CAS Name: 3-[4-[(6-hydroxy-3-methyl-2-phenyl-1-naphthalenyl)oxy]anilino]-3-oxopropanoic acid IUPAC Name: 3-[4-(6-hydroxy-3-methyl-2-phenylnaphthalen-1-yl)oxyanilino]-3-oxopropanoic acid Traditional Name: 3-[4-(6-hydroxy-3-methyl-2-phenyl-1-naphthoxy)anilino]-3-keto-propionic acid Formula: C26H21NO5 MolecularWeight: 427.44864

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=C2C=CC(=CC2=C1)O)OC3=CC=C(C=C3)NC(=O)CC(=O)O)C4=CC=CC=C4

Isomeric SMILES

CC1=C(C(=C2C=CC(=CC2=C1)O)OC3=CC=C(C=C3)NC(=O)CC(=O)O)C4=CC=CC=C4

InChI

InChI=1S/C26H21NO5/c1-16-13-18-14-20(28)9-12-22(18)26(25(16)17-5-3-2-4-6-17)32-21-10-7-19(8-11-21)27-23(29)15-24(30)31/h2-14,28H,15H2,1H3,(H,27,29)(H,30,31)