tert-butyl 3-[2-[(3S)-3-ethyl-2-oxidanylidene-3-(3-oxidanylpropyl)piperidin-1-yl]ethyl]indole-1-carboxylate

Systemtic Name: tert-butyl 3-[2-[(3S)-3-ethyl-2-oxidanylidene-3-(3-oxidanylpropyl)piperidin-1-yl]ethyl]indole-1-carboxylate Openeye Name: tert-butyl 3-[2-[(3S)-3-ethyl-3-(3-hydroxypropyl)-2-oxo-1-piperidyl]ethyl]indole-1-carboxylate CAS Name: 3-[2-[(3S)-3-ethyl-3-(3-hydroxypropyl)-2-oxo-1-piperidinyl]ethyl]-1-indolecarboxylic acid tert-butyl ester IUPAC Name: tert-butyl 3-[2-[(3S)-3-ethyl-3-(3-hydroxypropyl)-2-oxopiperidin-1-yl]ethyl]indole-1-carboxylate Traditional Name: 3-[2-[(3S)-3-ethyl-3-(3-hydroxypropyl)-2-keto-piperidino]ethyl]indole-1-carboxylic acid tert-butyl ester Formula: C25H36N2O4 MolecularWeight: 428.56434

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCC1(CCCN(C1=O)CCC2=CN(C3=CC=CC=C32)C(=O)OC(C)(C)C)CCCO

Isomeric SMILES

CC[C@]1(CCCN(C1=O)CCC2=CN(C3=CC=CC=C32)C(=O)OC(C)(C)C)CCCO

InChI

InChI=1S/C25H36N2O4/c1-5-25(14-9-17-28)13-8-15-26(22(25)29)16-12-19-18-27(23(30)31-24(2,3)4)21-11-7-6-10-20(19)21/h6-7,10-11,18,28H,5,8-9,12-17H2,1-4H3/t25-/m0/s1