3-[2-[3-(3,5-dimethylpiperidin-1-yl)propylamino]-2-oxidanylidene-ethyl]-1H-indole-2-carboxylic acid

Systemtic Name: 3-[2-[3-(3,5-dimethylpiperidin-1-yl)propylamino]-2-oxidanylidene-ethyl]-1H-indole-2-carboxylic acid Openeye Name: 3-[2-[3-(3,5-dimethyl-1-piperidyl)propylamino]-2-oxo-ethyl]-1H-indole-2-carboxylic acid CAS Name: 3-[2-[3-(3,5-dimethyl-1-piperidinyl)propylamino]-2-oxoethyl]-1H-indole-2-carboxylic acid IUPAC Name: 3-[2-[3-(3,5-dimethylpiperidin-1-yl)propylamino]-2-oxoethyl]-1H-indole-2-carboxylic acid Traditional Name: 3-[2-[3-(3,5-dimethylpiperidino)propylamino]-2-keto-ethyl]-1H-indole-2-carboxylic acid Formula: C21H29N3O3 MolecularWeight: 371.47326

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Descriptors Computed from Structure

Canonical SMILES:

CC1CC(CN(C1)CCCNC(=O)CC2=C(NC3=CC=CC=C32)C(=O)O)C

Isomeric SMILES

CC1CC(CN(C1)CCCNC(=O)CC2=C(NC3=CC=CC=C32)C(=O)O)C

InChI

InChI=1S/C21H29N3O3/c1-14-10-15(2)13-24(12-14)9-5-8-22-19(25)11-17-16-6-3-4-7-18(16)23-20(17)21(26)27/h3-4,6-7,14-15,23H,5,8-13H2,1-2H3,(H,22,25)(H,26,27)