3-(4-azanylbutyl)-2-(4-tert-butylphenyl)-7-methyl-1H-indole-4-carboxylic acid

Systemtic Name: 3-(4-azanylbutyl)-2-(4-tert-butylphenyl)-7-methyl-1H-indole-4-carboxylic acid Openeye Name: 3-(4-aminobutyl)-2-(4-tert-butylphenyl)-7-methyl-1H-indole-4-carboxylic acid CAS Name: 3-(4-aminobutyl)-2-(4-tert-butylphenyl)-7-methyl-1H-indole-4-carboxylic acid IUPAC Name: 3-(4-aminobutyl)-2-(4-tert-butylphenyl)-7-methyl-1H-indole-4-carboxylic acid Traditional Name: 3-(4-aminobutyl)-2-(4-tert-butylphenyl)-7-methyl-1H-indole-4-carboxylic acid Formula: C24H30N2O2 MolecularWeight: 378.5072

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C2C(=C(C=C1)C(=O)O)C(=C(N2)C3=CC=C(C=C3)C(C)(C)C)CCCCN

Isomeric SMILES

CC1=C2C(=C(C=C1)C(=O)O)C(=C(N2)C3=CC=C(C=C3)C(C)(C)C)CCCCN

InChI

InChI=1S/C24H30N2O2/c1-15-8-13-19(23(27)28)20-18(7-5-6-14-25)22(26-21(15)20)16-9-11-17(12-10-16)24(2,3)4/h8-13,26H,5-7,14,25H2,1-4H3,(H,27,28)