tert-butyl (3R,4S)-4-[bis(phenylmethyl)amino]-2-oxidanylidene-3-prop-2-enyl-piperidine-1-carboxylate

Systemtic Name: tert-butyl (3R,4S)-4-[bis(phenylmethyl)amino]-2-oxidanylidene-3-prop-2-enyl-piperidine-1-carboxylate Openeye Name: tert-butyl (3R,4S)-3-allyl-4-(dibenzylamino)-2-oxo-piperidine-1-carboxylate CAS Name: (3R,4S)-4-[bis(phenylmethyl)amino]-2-oxo-3-prop-2-enyl-1-piperidinecarboxylic acid tert-butyl ester IUPAC Name: tert-butyl (3R,4S)-4-(dibenzylamino)-2-oxo-3-prop-2-enylpiperidine-1-carboxylate Traditional Name: (3R,4S)-3-allyl-4-(dibenzylamino)-2-keto-piperidine-1-carboxylic acid tert-butyl ester Formula: C27H34N2O3 MolecularWeight: 434.57046

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)OC(=O)N1CCC(C(C1=O)CC=C)N(CC2=CC=CC=C2)CC3=CC=CC=C3

Isomeric SMILES

CC(C)(C)OC(=O)N1CC[C@@H]([C@H](C1=O)CC=C)N(CC2=CC=CC=C2)CC3=CC=CC=C3

InChI

InChI=1S/C27H34N2O3/c1-5-12-23-24(17-18-29(25(23)30)26(31)32-27(2,3)4)28(19-21-13-8-6-9-14-21)20-22-15-10-7-11-16-22/h5-11,13-16,23-24H,1,12,17-20H2,2-4H3/t23-,24+/m1/s1