N-[(2S)-1-(cyclooctylamino)-3-oxidanyl-1-oxidanylidene-propan-2-yl]-1H-indole-2-carboxamide

Systemtic Name: N-[(2S)-1-(cyclooctylamino)-3-oxidanyl-1-oxidanylidene-propan-2-yl]-1H-indole-2-carboxamide Openeye Name: N-[(1S)-2-(cyclooctylamino)-1-(hydroxymethyl)-2-oxo-ethyl]-1H-indole-2-carboxamide CAS Name: N-[(2S)-1-(cyclooctylamino)-3-hydroxy-1-oxopropan-2-yl]-1H-indole-2-carboxamide IUPAC Name: N-[(2S)-1-(cyclooctylamino)-3-hydroxy-1-oxopropan-2-yl]-1H-indole-2-carboxamide Traditional Name: N-[(1S)-2-(cyclooctylamino)-2-keto-1-methylol-ethyl]-1H-indole-2-carboxamide Formula: C20H27N3O3 MolecularWeight: 357.44668

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Descriptors Computed from Structure

Canonical SMILES:

C1CCCC(CCC1)NC(=O)C(CO)NC(=O)C2=CC3=CC=CC=C3N2

Isomeric SMILES

C1CCCC(CCC1)NC(=O)[C@H](CO)NC(=O)C2=CC3=CC=CC=C3N2

InChI

InChI=1S/C20H27N3O3/c24-13-18(20(26)21-15-9-4-2-1-3-5-10-15)23-19(25)17-12-14-8-6-7-11-16(14)22-17/h6-8,11-12,15,18,22,24H,1-5,9-10,13H2,(H,21,26)(H,23,25)/t18-/m0/s1