2-(5-benzamido-1H-indol-3-yl)-2-[(3R,5S)-3,5-dimethylpiperidin-1-yl]ethanoic acid

Systemtic Name: 2-(5-benzamido-1H-indol-3-yl)-2-[(3R,5S)-3,5-dimethylpiperidin-1-yl]ethanoic acid Openeye Name: 2-(5-benzamido-1H-indol-3-yl)-2-[(3R,5S)-3,5-dimethyl-1-piperidyl]acetic acid CAS Name: 2-(5-benzamido-1H-indol-3-yl)-2-[(3R,5S)-3,5-dimethyl-1-piperidinyl]acetic acid IUPAC Name: 2-(5-benzamido-1H-indol-3-yl)-2-[(3R,5S)-3,5-dimethylpiperidin-1-yl]acetic acid Traditional Name: 2-(5-benzamido-1H-indol-3-yl)-2-[(3R,5S)-3,5-dimethylpiperidino]acetic acid Formula: C24H27N3O3 MolecularWeight: 405.48948

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Descriptors Computed from Structure

Canonical SMILES:

CC1CC(CN(C1)C(C2=CNC3=C2C=C(C=C3)NC(=O)C4=CC=CC=C4)C(=O)O)C

Isomeric SMILES

C[C@@H]1C[C@@H](CN(C1)C(C2=CNC3=C2C=C(C=C3)NC(=O)C4=CC=CC=C4)C(=O)O)C

InChI

InChI=1S/C24H27N3O3/c1-15-10-16(2)14-27(13-15)22(24(29)30)20-12-25-21-9-8-18(11-19(20)21)26-23(28)17-6-4-3-5-7-17/h3-9,11-12,15-16,22,25H,10,13-14H2,1-2H3,(H,26,28)(H,29,30)/t15-,16+,22?