methyl 4-(2-chlorophenyl)carbonyl-5-methyl-2-(2-nitroethyl)-1H-pyrrole-3-carboxylate

Systemtic Name: methyl 4-(2-chlorophenyl)carbonyl-5-methyl-2-(2-nitroethyl)-1H-pyrrole-3-carboxylate Openeye Name: methyl 4-(2-chlorobenzoyl)-5-methyl-2-(2-nitroethyl)-1H-pyrrole-3-carboxylate CAS Name: 4-[(2-chlorophenyl)-oxomethyl]-5-methyl-2-(2-nitroethyl)-1H-pyrrole-3-carboxylic acid methyl ester IUPAC Name: methyl 4-(2-chlorobenzoyl)-5-methyl-2-(2-nitroethyl)-1H-pyrrole-3-carboxylate Traditional Name: 4-(2-chlorobenzoyl)-5-methyl-2-(2-nitroethyl)-1H-pyrrole-3-carboxylic acid methyl ester Formula: C16H15ClN2O5 MolecularWeight: 350.7537

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=C(N1)CC[N+](=O)[O-])C(=O)OC)C(=O)C2=CC=CC=C2Cl

Isomeric SMILES

CC1=C(C(=C(N1)CC[N+](=O)[O-])C(=O)OC)C(=O)C2=CC=CC=C2Cl

InChI

InChI=1S/C16H15ClN2O5/c1-9-13(15(20)10-5-3-4-6-11(10)17)14(16(21)24-2)12(18-9)7-8-19(22)23/h3-6,18H,7-8H2,1-2H3