methyl 2-ethyl-4-methyl-5-[[2-(4-nitrophenyl)-2-oxidanyl-ethyl]carbamoyl]-1H-pyrrole-3-carboxylate

Systemtic Name: methyl 2-ethyl-4-methyl-5-[[2-(4-nitrophenyl)-2-oxidanyl-ethyl]carbamoyl]-1H-pyrrole-3-carboxylate Openeye Name: methyl 2-ethyl-5-[[2-hydroxy-2-(4-nitrophenyl)ethyl]carbamoyl]-4-methyl-1H-pyrrole-3-carboxylate CAS Name: 2-ethyl-5-[[[2-hydroxy-2-(4-nitrophenyl)ethyl]amino]-oxomethyl]-4-methyl-1H-pyrrole-3-carboxylic acid methyl ester IUPAC Name: methyl 2-ethyl-5-[[2-hydroxy-2-(4-nitrophenyl)ethyl]carbamoyl]-4-methyl-1H-pyrrole-3-carboxylate Traditional Name: 2-ethyl-5-[[2-hydroxy-2-(4-nitrophenyl)ethyl]carbamoyl]-4-methyl-1H-pyrrole-3-carboxylic acid methyl ester Formula: C18H21N3O6 MolecularWeight: 375.37584

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=C(C(=C(N1)C(=O)NCC(C2=CC=C(C=C2)[N+](=O)[O-])O)C)C(=O)OC

Isomeric SMILES

CCC1=C(C(=C(N1)C(=O)NCC(C2=CC=C(C=C2)[N+](=O)[O-])O)C)C(=O)OC

InChI

InChI=1S/C18H21N3O6/c1-4-13-15(18(24)27-3)10(2)16(20-13)17(23)19-9-14(22)11-5-7-12(8-6-11)21(25)26/h5-8,14,20,22H,4,9H2,1-3H3,(H,19,23)