1-[1-(butylamino)-1-oxidanylidene-propan-2-yl]indole-4-carboxylic acid

Systemtic Name: 1-[1-(butylamino)-1-oxidanylidene-propan-2-yl]indole-4-carboxylic acid Openeye Name: 1-[2-(butylamino)-1-methyl-2-oxo-ethyl]indole-4-carboxylic acid CAS Name: 1-[1-(butylamino)-1-oxopropan-2-yl]-4-indolecarboxylic acid IUPAC Name: 1-[1-(butylamino)-1-oxopropan-2-yl]indole-4-carboxylic acid Traditional Name: 1-[2-(butylamino)-2-keto-1-methyl-ethyl]indole-4-carboxylic acid Formula: C16H20N2O3 MolecularWeight: 288.3416

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Descriptors Computed from Structure

Canonical SMILES:

CCCCNC(=O)C(C)N1C=CC2=C(C=CC=C21)C(=O)O

Isomeric SMILES

CCCCNC(=O)C(C)N1C=CC2=C(C=CC=C21)C(=O)O

InChI

InChI=1S/C16H20N2O3/c1-3-4-9-17-15(19)11(2)18-10-8-12-13(16(20)21)6-5-7-14(12)18/h5-8,10-11H,3-4,9H2,1-2H3,(H,17,19)(H,20,21)