ethyl 5-[2-[[(2S)-butan-2-yl]amino]-2-oxidanylidene-ethanoyl]-4-(4-methoxyphenyl)-2-methyl-1H-pyrrole-3-carboxylate

Systemtic Name: ethyl 5-[2-[[(2S)-butan-2-yl]amino]-2-oxidanylidene-ethanoyl]-4-(4-methoxyphenyl)-2-methyl-1H-pyrrole-3-carboxylate Openeye Name: ethyl 4-(4-methoxyphenyl)-2-methyl-5-[2-[[(1S)-1-methylpropyl]amino]-2-oxo-acetyl]-1H-pyrrole-3-carboxylate CAS Name: 5-[2-[[(2S)-butan-2-yl]amino]-1,2-dioxoethyl]-4-(4-methoxyphenyl)-2-methyl-1H-pyrrole-3-carboxylic acid ethyl ester IUPAC Name: ethyl 5-[2-[[(2S)-butan-2-yl]amino]-2-oxoacetyl]-4-(4-methoxyphenyl)-2-methyl-1H-pyrrole-3-carboxylate Traditional Name: 5-[2-keto-2-[[(1S)-1-methylpropyl]amino]acetyl]-4-(4-methoxyphenyl)-2-methyl-1H-pyrrole-3-carboxylic acid ethyl ester Formula: C21H26N2O5 MolecularWeight: 386.44154

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C)NC(=O)C(=O)C1=C(C(=C(N1)C)C(=O)OCC)C2=CC=C(C=C2)OC

Isomeric SMILES

CC[C@H](C)NC(=O)C(=O)C1=C(C(=C(N1)C)C(=O)OCC)C2=CC=C(C=C2)OC

InChI

InChI=1S/C21H26N2O5/c1-6-12(3)22-20(25)19(24)18-17(14-8-10-15(27-5)11-9-14)16(13(4)23-18)21(26)28-7-2/h8-12,23H,6-7H2,1-5H3,(H,22,25)/t12-/m0/s1