tert-butyl (2S)-2-[[1-[2-(3-methoxyphenyl)-2-oxidanylidene-ethyl]piperidin-2-yl]carbonylamino]-3-phenyl-propanoate

Systemtic Name: tert-butyl (2S)-2-[[1-[2-(3-methoxyphenyl)-2-oxidanylidene-ethyl]piperidin-2-yl]carbonylamino]-3-phenyl-propanoate Openeye Name: tert-butyl (2S)-2-[[1-[2-(3-methoxyphenyl)-2-oxo-ethyl]piperidine-2-carbonyl]amino]-3-phenyl-propanoate CAS Name: (2S)-2-[[[1-[2-(3-methoxyphenyl)-2-oxoethyl]-2-piperidinyl]-oxomethyl]amino]-3-phenylpropanoic acid tert-butyl ester IUPAC Name: tert-butyl (2S)-2-[[1-[2-(3-methoxyphenyl)-2-oxoethyl]piperidine-2-carbonyl]amino]-3-phenylpropanoate Traditional Name: (2S)-2-[[1-[2-keto-2-(3-methoxyphenyl)ethyl]pipecoloyl]amino]-3-phenyl-propionic acid tert-butyl ester Formula: C28H36N2O5 MolecularWeight: 480.59584

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)OC(=O)C(CC1=CC=CC=C1)NC(=O)C2CCCCN2CC(=O)C3=CC(=CC=C3)OC

Isomeric SMILES

CC(C)(C)OC(=O)[C@H](CC1=CC=CC=C1)NC(=O)C2CCCCN2CC(=O)C3=CC(=CC=C3)OC

InChI

InChI=1S/C28H36N2O5/c1-28(2,3)35-27(33)23(17-20-11-6-5-7-12-20)29-26(32)24-15-8-9-16-30(24)19-25(31)21-13-10-14-22(18-21)34-4/h5-7,10-14,18,23-24H,8-9,15-17,19H2,1-4H3,(H,29,32)/t23-,24?/m0/s1