methyl 3-(1-acetamido-2-methoxy-2-methyl-pentyl)-4-[(2-methylpropan-2-yl)oxycarbonylamino]cyclopentene-1-carboxylate

Systemtic Name: methyl 3-(1-acetamido-2-methoxy-2-methyl-pentyl)-4-[(2-methylpropan-2-yl)oxycarbonylamino]cyclopentene-1-carboxylate Openeye Name: methyl 3-(1-acetamido-2-methoxy-2-methyl-pentyl)-4-(tert-butoxycarbonylamino)cyclopentene-1-carboxylate CAS Name: 3-(1-acetamido-2-methoxy-2-methylpentyl)-4-[[(2-methylpropan-2-yl)oxy-oxomethyl]amino]-1-cyclopentenecarboxylic acid methyl ester IUPAC Name: methyl 3-(1-acetamido-2-methoxy-2-methylpentyl)-4-[(2-methylpropan-2-yl)oxycarbonylamino]cyclopentene-1-carboxylate Traditional Name: 3-(1-acetamido-2-methoxy-2-methyl-pentyl)-4-(tert-butoxycarbonylamino)cyclopentene-1-carboxylic acid methyl ester Formula: C21H36N2O6 MolecularWeight: 412.52034

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Descriptors Computed from Structure

Canonical SMILES:

CCCC(C)(C(C1C=C(CC1NC(=O)OC(C)(C)C)C(=O)OC)NC(=O)C)OC

Isomeric SMILES

CCCC(C)(C(C1C=C(CC1NC(=O)OC(C)(C)C)C(=O)OC)NC(=O)C)OC

InChI

InChI=1S/C21H36N2O6/c1-9-10-21(6,28-8)17(22-13(2)24)15-11-14(18(25)27-7)12-16(15)23-19(26)29-20(3,4)5/h11,15-17H,9-10,12H2,1-8H3,(H,22,24)(H,23,26)