2-[8-tert-butyl-2-(phenylcarbonyl)-3,4-dihydro-1H-pyrido[4,3-b]indol-5-yl]ethanoic acid

Systemtic Name: 2-[8-tert-butyl-2-(phenylcarbonyl)-3,4-dihydro-1H-pyrido[4,3-b]indol-5-yl]ethanoic acid Openeye Name: 2-(2-benzoyl-8-tert-butyl-3,4-dihydro-1H-pyrido[4,3-b]indol-5-yl)acetic acid CAS Name: 2-(2-benzoyl-8-tert-butyl-3,4-dihydro-1H-pyrido[4,3-b]indol-5-yl)acetic acid IUPAC Name: 2-(2-benzoyl-8-tert-butyl-3,4-dihydro-1H-pyrido[4,3-b]indol-5-yl)acetic acid Traditional Name: 2-(2-benzoyl-8-tert-butyl-3,4-dihydro-1H-pyrid[4,3-b]indol-5-yl)acetic acid Formula: C24H26N2O3 MolecularWeight: 390.47484

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C1=CC2=C(C=C1)N(C3=C2CN(CC3)C(=O)C4=CC=CC=C4)CC(=O)O

Isomeric SMILES

CC(C)(C)C1=CC2=C(C=C1)N(C3=C2CN(CC3)C(=O)C4=CC=CC=C4)CC(=O)O

InChI

InChI=1S/C24H26N2O3/c1-24(2,3)17-9-10-20-18(13-17)19-14-25(23(29)16-7-5-4-6-8-16)12-11-21(19)26(20)15-22(27)28/h4-10,13H,11-12,14-15H2,1-3H3,(H,27,28)