4-[[5-oxidanylidene-1-[4-[(4-propan-2-ylphenyl)methoxy]phenyl]pyrrolidin-3-yl]methoxy]benzoic acid

Systemtic Name: 4-[[5-oxidanylidene-1-[4-[(4-propan-2-ylphenyl)methoxy]phenyl]pyrrolidin-3-yl]methoxy]benzoic acid Openeye Name: 4-[[1-[4-[(4-isopropylphenyl)methoxy]phenyl]-5-oxo-pyrrolidin-3-yl]methoxy]benzoic acid CAS Name: 4-[[5-oxo-1-[4-[(4-propan-2-ylphenyl)methoxy]phenyl]-3-pyrrolidinyl]methoxy]benzoic acid IUPAC Name: 4-[[5-oxo-1-[4-[(4-propan-2-ylphenyl)methoxy]phenyl]pyrrolidin-3-yl]methoxy]benzoic acid Traditional Name: 4-[[1-[4-(4-isopropylbenzyl)oxyphenyl]-5-keto-pyrrolidin-3-yl]methoxy]benzoic acid Formula: C28H29NO5 MolecularWeight: 459.53356

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C1=CC=C(C=C1)COC2=CC=C(C=C2)N3CC(CC3=O)COC4=CC=C(C=C4)C(=O)O

Isomeric SMILES

CC(C)C1=CC=C(C=C1)COC2=CC=C(C=C2)N3CC(CC3=O)COC4=CC=C(C=C4)C(=O)O

InChI

InChI=1S/C28H29NO5/c1-19(2)22-5-3-20(4-6-22)17-33-26-13-9-24(10-14-26)29-16-21(15-27(29)30)18-34-25-11-7-23(8-12-25)28(31)32/h3-14,19,21H,15-18H2,1-2H3,(H,31,32)