4-[[3-[2-(3-methyl-4-propan-2-yl-phenoxy)ethoxy]phenyl]methylamino]-4-oxidanylidene-butanoic acid

Systemtic Name: 4-[[3-[2-(3-methyl-4-propan-2-yl-phenoxy)ethoxy]phenyl]methylamino]-4-oxidanylidene-butanoic acid Openeye Name: 4-[[3-[2-(4-isopropyl-3-methyl-phenoxy)ethoxy]phenyl]methylamino]-4-oxo-butanoic acid CAS Name: 4-[[3-[2-(3-methyl-4-propan-2-ylphenoxy)ethoxy]phenyl]methylamino]-4-oxobutanoic acid IUPAC Name: 4-[[3-[2-(3-methyl-4-propan-2-ylphenoxy)ethoxy]phenyl]methylamino]-4-oxobutanoic acid Traditional Name: 4-[[3-[2-(4-isopropyl-3-methyl-phenoxy)ethoxy]benzyl]amino]-4-keto-butyric acid Formula: C23H29NO5 MolecularWeight: 399.48006

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=CC(=C1)OCCOC2=CC=CC(=C2)CNC(=O)CCC(=O)O)C(C)C

Isomeric SMILES

CC1=C(C=CC(=C1)OCCOC2=CC=CC(=C2)CNC(=O)CCC(=O)O)C(C)C

InChI

InChI=1S/C23H29NO5/c1-16(2)21-8-7-20(13-17(21)3)29-12-11-28-19-6-4-5-18(14-19)15-24-22(25)9-10-23(26)27/h4-8,13-14,16H,9-12,15H2,1-3H3,(H,24,25)(H,26,27)