tert-butyl 4-[(E)-3-[3-[(3-methoxy-3-oxidanylidene-1-phenyl-propyl)carbamoyl]piperidin-1-yl]-3-oxidanylidene-prop-1-enyl]piperidine-1-carboxylate

Systemtic Name: tert-butyl 4-[(E)-3-[3-[(3-methoxy-3-oxidanylidene-1-phenyl-propyl)carbamoyl]piperidin-1-yl]-3-oxidanylidene-prop-1-enyl]piperidine-1-carboxylate Openeye Name: tert-butyl 4-[(E)-3-[3-[(3-methoxy-3-oxo-1-phenyl-propyl)carbamoyl]-1-piperidyl]-3-oxo-prop-1-enyl]piperidine-1-carboxylate CAS Name: 4-[(E)-3-[3-[[(3-methoxy-3-oxo-1-phenylpropyl)amino]-oxomethyl]-1-piperidinyl]-3-oxoprop-1-enyl]-1-piperidinecarboxylic acid tert-butyl ester IUPAC Name: tert-butyl 4-[(E)-3-[3-[(3-methoxy-3-oxo-1-phenylpropyl)carbamoyl]piperidin-1-yl]-3-oxoprop-1-enyl]piperidine-1-carboxylate Traditional Name: 4-[(E)-3-keto-3-[3-[(3-keto-3-methoxy-1-phenyl-propyl)carbamoyl]piperidino]prop-1-enyl]piperidine-1-carboxylic acid tert-butyl ester Formula: C29H41N3O6 MolecularWeight: 527.65234

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)OC(=O)N1CCC(CC1)C=CC(=O)N2CCCC(C2)C(=O)NC(CC(=O)OC)C3=CC=CC=C3

Isomeric SMILES

CC(C)(C)OC(=O)N1CCC(CC1)/C=C/C(=O)N2CCCC(C2)C(=O)NC(CC(=O)OC)C3=CC=CC=C3

InChI

InChI=1S/C29H41N3O6/c1-29(2,3)38-28(36)31-17-14-21(15-18-31)12-13-25(33)32-16-8-11-23(20-32)27(35)30-24(19-26(34)37-4)22-9-6-5-7-10-22/h5-7,9-10,12-13,21,23-24H,8,11,14-20H2,1-4H3,(H,30,35)/b13-12+