methyl 5-[[(4-butoxy-3-methoxy-phenyl)carbonylamino]carbamoyl]-2,4-dimethyl-1H-pyrrole-3-carboxylate

Systemtic Name: methyl 5-[[(4-butoxy-3-methoxy-phenyl)carbonylamino]carbamoyl]-2,4-dimethyl-1H-pyrrole-3-carboxylate Openeye Name: methyl 5-[[(4-butoxy-3-methoxy-benzoyl)amino]carbamoyl]-2,4-dimethyl-1H-pyrrole-3-carboxylate CAS Name: 5-[[[(4-butoxy-3-methoxyphenyl)-oxomethyl]hydrazo]-oxomethyl]-2,4-dimethyl-1H-pyrrole-3-carboxylic acid methyl ester IUPAC Name: methyl 5-[[(4-butoxy-3-methoxybenzoyl)amino]carbamoyl]-2,4-dimethyl-1H-pyrrole-3-carboxylate Traditional Name: 5-[[(4-butoxy-3-methoxy-benzoyl)amino]carbamoyl]-2,4-dimethyl-1H-pyrrole-3-carboxylic acid methyl ester Formula: C21H27N3O6 MolecularWeight: 417.45558

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Descriptors Computed from Structure

Canonical SMILES:

CCCCOC1=C(C=C(C=C1)C(=O)NNC(=O)C2=C(C(=C(N2)C)C(=O)OC)C)OC

Isomeric SMILES

CCCCOC1=C(C=C(C=C1)C(=O)NNC(=O)C2=C(C(=C(N2)C)C(=O)OC)C)OC

InChI

InChI=1S/C21H27N3O6/c1-6-7-10-30-15-9-8-14(11-16(15)28-4)19(25)23-24-20(26)18-12(2)17(13(3)22-18)21(27)29-5/h8-9,11,22H,6-7,10H2,1-5H3,(H,23,25)(H,24,26)