2-[2-[4-(2-methoxyphenyl)-2,2-dimethyl-oxan-4-yl]ethylcarbamoyl]benzoic acid

Systemtic Name: 2-[2-[4-(2-methoxyphenyl)-2,2-dimethyl-oxan-4-yl]ethylcarbamoyl]benzoic acid Openeye Name: 2-[2-[4-(2-methoxyphenyl)-2,2-dimethyl-tetrahydropyran-4-yl]ethylcarbamoyl]benzoic acid CAS Name: 2-[[2-[4-(2-methoxyphenyl)-2,2-dimethyl-4-oxanyl]ethylamino]-oxomethyl]benzoic acid IUPAC Name: 2-[2-[4-(2-methoxyphenyl)-2,2-dimethyloxan-4-yl]ethylcarbamoyl]benzoic acid Traditional Name: 2-[2-[4-(2-methoxyphenyl)-2,2-dimethyl-tetrahydropyran-4-yl]ethylcarbamoyl]benzoic acid Formula: C24H29NO5 MolecularWeight: 411.49076

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Descriptors Computed from Structure

Canonical SMILES:

CC1(CC(CCO1)(CCNC(=O)C2=CC=CC=C2C(=O)O)C3=CC=CC=C3OC)C

Isomeric SMILES

CC1(CC(CCO1)(CCNC(=O)C2=CC=CC=C2C(=O)O)C3=CC=CC=C3OC)C

InChI

InChI=1S/C24H29NO5/c1-23(2)16-24(13-15-30-23,19-10-6-7-11-20(19)29-3)12-14-25-21(26)17-8-4-5-9-18(17)22(27)28/h4-11H,12-16H2,1-3H3,(H,25,26)(H,27,28)