1-(3-tert-butyl-5-methyl-phenyl)-2,3,4,9-tetrahydro-1H-pyrido[3,4-b]indole-3-carboxylic acid

Systemtic Name: 1-(3-tert-butyl-5-methyl-phenyl)-2,3,4,9-tetrahydro-1H-pyrido[3,4-b]indole-3-carboxylic acid Openeye Name: 1-(3-tert-butyl-5-methyl-phenyl)-2,3,4,9-tetrahydro-1H-pyrido[3,4-b]indole-3-carboxylic acid CAS Name: 1-(3-tert-butyl-5-methylphenyl)-2,3,4,9-tetrahydro-1H-pyrido[3,4-b]indole-3-carboxylic acid IUPAC Name: 1-(3-tert-butyl-5-methylphenyl)-2,3,4,9-tetrahydro-1H-pyrido[3,4-b]indole-3-carboxylic acid Traditional Name: 1-(3-tert-butyl-5-methyl-phenyl)-2,3,4,9-tetrahydro-1H-$b-carboline-3-carboxylic acid Formula: C23H26N2O2 MolecularWeight: 362.46474

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC(=C1)C2C3=C(CC(N2)C(=O)O)C4=CC=CC=C4N3)C(C)(C)C

Isomeric SMILES

CC1=CC(=CC(=C1)C2C3=C(CC(N2)C(=O)O)C4=CC=CC=C4N3)C(C)(C)C

InChI

InChI=1S/C23H26N2O2/c1-13-9-14(11-15(10-13)23(2,3)4)20-21-17(12-19(25-20)22(26)27)16-7-5-6-8-18(16)24-21/h5-11,19-20,24-25H,12H2,1-4H3,(H,26,27)