tert-butyl 3-[(1-ethanoyl-2,3-dihydroindol-5-yl)carbamoyl]piperidine-1-carboxylate

Systemtic Name: tert-butyl 3-[(1-ethanoyl-2,3-dihydroindol-5-yl)carbamoyl]piperidine-1-carboxylate Openeye Name: tert-butyl 3-[(1-acetylindolin-5-yl)carbamoyl]piperidine-1-carboxylate CAS Name: 3-[[(1-acetyl-2,3-dihydroindol-5-yl)amino]-oxomethyl]-1-piperidinecarboxylic acid tert-butyl ester IUPAC Name: tert-butyl 3-[(1-acetyl-2,3-dihydroindol-5-yl)carbamoyl]piperidine-1-carboxylate Traditional Name: 3-[(1-acetylindolin-5-yl)carbamoyl]piperidine-1-carboxylic acid tert-butyl ester Formula: C21H29N3O4 MolecularWeight: 387.47266

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)N1CCC2=C1C=CC(=C2)NC(=O)C3CCCN(C3)C(=O)OC(C)(C)C

Isomeric SMILES

CC(=O)N1CCC2=C1C=CC(=C2)NC(=O)C3CCCN(C3)C(=O)OC(C)(C)C

InChI

InChI=1S/C21H29N3O4/c1-14(25)24-11-9-15-12-17(7-8-18(15)24)22-19(26)16-6-5-10-23(13-16)20(27)28-21(2,3)4/h7-8,12,16H,5-6,9-11,13H2,1-4H3,(H,22,26)