ethyl 2,4-dimethyl-5-[2-(3-nitro-4-phenylsulfanyl-phenyl)carbonyloxyethanoyl]-1H-pyrrole-3-carboxylate

Systemtic Name: ethyl 2,4-dimethyl-5-[2-(3-nitro-4-phenylsulfanyl-phenyl)carbonyloxyethanoyl]-1H-pyrrole-3-carboxylate Openeye Name: ethyl 2,4-dimethyl-5-[2-(3-nitro-4-phenylsulfanyl-benzoyl)oxyacetyl]-1H-pyrrole-3-carboxylate CAS Name: 2,4-dimethyl-5-[2-[[3-nitro-4-(phenylthio)phenyl]-oxomethoxy]-1-oxoethyl]-1H-pyrrole-3-carboxylic acid ethyl ester IUPAC Name: ethyl 2,4-dimethyl-5-[2-(3-nitro-4-phenylsulfanylbenzoyl)oxyacetyl]-1H-pyrrole-3-carboxylate Traditional Name: 2,4-dimethyl-5-[2-[3-nitro-4-(phenylthio)benzoyl]oxyacetyl]-1H-pyrrole-3-carboxylic acid ethyl ester Formula: C24H22N2O7S MolecularWeight: 482.50568

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(NC(=C1C)C(=O)COC(=O)C2=CC(=C(C=C2)SC3=CC=CC=C3)[N+](=O)[O-])C

Isomeric SMILES

CCOC(=O)C1=C(NC(=C1C)C(=O)COC(=O)C2=CC(=C(C=C2)SC3=CC=CC=C3)[N+](=O)[O-])C

InChI

InChI=1S/C24H22N2O7S/c1-4-32-24(29)21-14(2)22(25-15(21)3)19(27)13-33-23(28)16-10-11-20(18(12-16)26(30)31)34-17-8-6-5-7-9-17/h5-12,25H,4,13H2,1-3H3