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

Systemtic Name: tert-butyl 4-[(E)-3-[3-[(1-benzamido-3-ethoxy-3-oxidanylidene-propyl)carbamoyl]piperidin-1-yl]-3-oxidanylidene-prop-1-enyl]piperidine-1-carboxylate Openeye Name: tert-butyl 4-[(E)-3-[3-[(1-benzamido-3-ethoxy-3-oxo-propyl)carbamoyl]-1-piperidyl]-3-oxo-prop-1-enyl]piperidine-1-carboxylate CAS Name: 4-[(E)-3-[3-[[(1-benzamido-3-ethoxy-3-oxopropyl)amino]-oxomethyl]-1-piperidinyl]-3-oxoprop-1-enyl]-1-piperidinecarboxylic acid tert-butyl ester IUPAC Name: tert-butyl 4-[(E)-3-[3-[(1-benzamido-3-ethoxy-3-oxopropyl)carbamoyl]piperidin-1-yl]-3-oxoprop-1-enyl]piperidine-1-carboxylate Traditional Name: 4-[(E)-3-[3-[(1-benzamido-3-ethoxy-3-keto-propyl)carbamoyl]piperidino]-3-keto-prop-1-enyl]piperidine-1-carboxylic acid tert-butyl ester Formula: C31H44N4O7 MolecularWeight: 584.70366

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)CC(NC(=O)C1CCCN(C1)C(=O)C=CC2CCN(CC2)C(=O)OC(C)(C)C)NC(=O)C3=CC=CC=C3

Isomeric SMILES

CCOC(=O)CC(NC(=O)C1CCCN(C1)C(=O)/C=C/C2CCN(CC2)C(=O)OC(C)(C)C)NC(=O)C3=CC=CC=C3

InChI

InChI=1S/C31H44N4O7/c1-5-41-27(37)20-25(32-28(38)23-10-7-6-8-11-23)33-29(39)24-12-9-17-35(21-24)26(36)14-13-22-15-18-34(19-16-22)30(40)42-31(2,3)4/h6-8,10-11,13-14,22,24-25H,5,9,12,15-21H2,1-4H3,(H,32,38)(H,33,39)/b14-13+