tert-butyl 1-cyclohexyl-2-[(4-methoxyphenyl)carbonylamino]-4,5-dimethyl-pyrrole-3-carboxylate

Systemtic Name: tert-butyl 1-cyclohexyl-2-[(4-methoxyphenyl)carbonylamino]-4,5-dimethyl-pyrrole-3-carboxylate Openeye Name: tert-butyl 1-cyclohexyl-2-[(4-methoxybenzoyl)amino]-4,5-dimethyl-pyrrole-3-carboxylate CAS Name: 1-cyclohexyl-2-[[(4-methoxyphenyl)-oxomethyl]amino]-4,5-dimethyl-3-pyrrolecarboxylic acid tert-butyl ester IUPAC Name: tert-butyl 1-cyclohexyl-2-[(4-methoxybenzoyl)amino]-4,5-dimethylpyrrole-3-carboxylate Traditional Name: 1-cyclohexyl-4,5-dimethyl-2-(p-anisoylamino)pyrrole-3-carboxylic acid tert-butyl ester Formula: C25H34N2O4 MolecularWeight: 426.54846

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(N(C(=C1C(=O)OC(C)(C)C)NC(=O)C2=CC=C(C=C2)OC)C3CCCCC3)C

Isomeric SMILES

CC1=C(N(C(=C1C(=O)OC(C)(C)C)NC(=O)C2=CC=C(C=C2)OC)C3CCCCC3)C

InChI

InChI=1S/C25H34N2O4/c1-16-17(2)27(19-10-8-7-9-11-19)22(21(16)24(29)31-25(3,4)5)26-23(28)18-12-14-20(30-6)15-13-18/h12-15,19H,7-11H2,1-6H3,(H,26,28)