5-[4-[[cyclohexylcarbonyl(cyclopropylmethyl)amino]methyl]phenyl]-2-oxidanyl-benzoic acid

Systemtic Name: 5-[4-[[cyclohexylcarbonyl(cyclopropylmethyl)amino]methyl]phenyl]-2-oxidanyl-benzoic acid Openeye Name: 5-[4-[[cyclohexanecarbonyl(cyclopropylmethyl)amino]methyl]phenyl]-2-hydroxy-benzoic acid CAS Name: 5-[4-[[[cyclohexyl(oxo)methyl]-(cyclopropylmethyl)amino]methyl]phenyl]-2-hydroxybenzoic acid IUPAC Name: 5-[4-[[cyclohexanecarbonyl(cyclopropylmethyl)amino]methyl]phenyl]-2-hydroxybenzoic acid Traditional Name: 5-[4-[[cyclohexanecarbonyl(cyclopropylmethyl)amino]methyl]phenyl]-2-hydroxy-benzoic acid Formula: C25H29NO4 MolecularWeight: 407.50206

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC(CC1)C(=O)N(CC2CC2)CC3=CC=C(C=C3)C4=CC(=C(C=C4)O)C(=O)O

Isomeric SMILES

C1CCC(CC1)C(=O)N(CC2CC2)CC3=CC=C(C=C3)C4=CC(=C(C=C4)O)C(=O)O

InChI

InChI=1S/C25H29NO4/c27-23-13-12-21(14-22(23)25(29)30)19-10-8-18(9-11-19)16-26(15-17-6-7-17)24(28)20-4-2-1-3-5-20/h8-14,17,20,27H,1-7,15-16H2,(H,29,30)