3-[2-(4-aminocarbonyl-4-piperidin-1-yl-piperidin-1-yl)-2-oxidanylidene-ethyl]-1-ethyl-indole-2-carboxylic acid

Systemtic Name: 3-[2-(4-aminocarbonyl-4-piperidin-1-yl-piperidin-1-yl)-2-oxidanylidene-ethyl]-1-ethyl-indole-2-carboxylic acid Openeye Name: 3-[2-[4-carbamoyl-4-(1-piperidyl)-1-piperidyl]-2-oxo-ethyl]-1-ethyl-indole-2-carboxylic acid CAS Name: 3-[2-[4-carbamoyl-4-(1-piperidinyl)-1-piperidinyl]-2-oxoethyl]-1-ethyl-2-indolecarboxylic acid IUPAC Name: 3-[2-(4-carbamoyl-4-piperidin-1-ylpiperidin-1-yl)-2-oxoethyl]-1-ethylindole-2-carboxylic acid Traditional Name: 3-[2-(4-carbamoyl-4-piperidino-piperidino)-2-keto-ethyl]-1-ethyl-indole-2-carboxylic acid Formula: C24H32N4O4 MolecularWeight: 440.53528

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Descriptors Computed from Structure

Canonical SMILES:

CCN1C2=CC=CC=C2C(=C1C(=O)O)CC(=O)N3CCC(CC3)(C(=O)N)N4CCCCC4

Isomeric SMILES

CCN1C2=CC=CC=C2C(=C1C(=O)O)CC(=O)N3CCC(CC3)(C(=O)N)N4CCCCC4

InChI

InChI=1S/C24H32N4O4/c1-2-28-19-9-5-4-8-17(19)18(21(28)22(30)31)16-20(29)26-14-10-24(11-15-26,23(25)32)27-12-6-3-7-13-27/h4-5,8-9H,2-3,6-7,10-16H2,1H3,(H2,25,32)(H,30,31)