methyl 2-[(2-methylpropan-2-yl)oxycarbonylamino]-5-(1-methylpyrrol-2-yl)pent-4-ynoate

Systemtic Name: methyl 2-[(2-methylpropan-2-yl)oxycarbonylamino]-5-(1-methylpyrrol-2-yl)pent-4-ynoate Openeye Name: methyl 2-(tert-butoxycarbonylamino)-5-(1-methylpyrrol-2-yl)pent-4-ynoate CAS Name: 2-[[(2-methylpropan-2-yl)oxy-oxomethyl]amino]-5-(1-methyl-2-pyrrolyl)-4-pentynoic acid methyl ester IUPAC Name: methyl 2-[(2-methylpropan-2-yl)oxycarbonylamino]-5-(1-methylpyrrol-2-yl)pent-4-ynoate Traditional Name: 2-(tert-butoxycarbonylamino)-5-(1-methylpyrrol-2-yl)pent-4-ynoic acid methyl ester Formula: C16H22N2O4 MolecularWeight: 306.35688

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)OC(=O)NC(CC#CC1=CC=CN1C)C(=O)OC

Isomeric SMILES

CC(C)(C)OC(=O)NC(CC#CC1=CC=CN1C)C(=O)OC

InChI

InChI=1S/C16H22N2O4/c1-16(2,3)22-15(20)17-13(14(19)21-5)10-6-8-12-9-7-11-18(12)4/h7,9,11,13H,10H2,1-5H3,(H,17,20)