ethyl 4,5-bis[(2R)-2-acetamido-3-methoxy-3-oxidanylidene-propyl]cyclohexa-1,4-diene-1-carboxylate

Systemtic Name: ethyl 4,5-bis[(2R)-2-acetamido-3-methoxy-3-oxidanylidene-propyl]cyclohexa-1,4-diene-1-carboxylate Openeye Name: ethyl 4,5-bis[(2R)-2-acetamido-3-methoxy-3-oxo-propyl]cyclohexa-1,4-diene-1-carboxylate CAS Name: 4,5-bis[(2R)-2-acetamido-3-methoxy-3-oxopropyl]-1-cyclohexa-1,4-dienecarboxylic acid ethyl ester IUPAC Name: ethyl 4,5-bis[(2R)-2-acetamido-3-methoxy-3-oxopropyl]cyclohexa-1,4-diene-1-carboxylate Traditional Name: 4,5-bis[(2R)-2-acetamido-3-keto-3-methoxy-propyl]cyclohexa-1,4-diene-1-carboxylic acid ethyl ester Formula: C21H30N2O8 MolecularWeight: 438.4715

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=CCC(=C(C1)CC(C(=O)OC)NC(=O)C)CC(C(=O)OC)NC(=O)C

Isomeric SMILES

CCOC(=O)C1=CCC(=C(C1)C[C@H](C(=O)OC)NC(=O)C)C[C@H](C(=O)OC)NC(=O)C

InChI

InChI=1S/C21H30N2O8/c1-6-31-19(26)15-8-7-14(10-17(20(27)29-4)22-12(2)24)16(9-15)11-18(21(28)30-5)23-13(3)25/h8,17-18H,6-7,9-11H2,1-5H3,(H,22,24)(H,23,25)/t17-,18-/m1/s1