tert-butyl 3-ethyl-5-[[(4-methoxyphenyl)amino]methyl]-4-[(1-methyl-5-oxidanylidene-pyrrolidin-2-yl)methylcarbamoyl]-1H-pyrrole-2-carboxylate

Systemtic Name: tert-butyl 3-ethyl-5-[[(4-methoxyphenyl)amino]methyl]-4-[(1-methyl-5-oxidanylidene-pyrrolidin-2-yl)methylcarbamoyl]-1H-pyrrole-2-carboxylate Openeye Name: tert-butyl 3-ethyl-5-[(4-methoxyanilino)methyl]-4-[(1-methyl-5-oxo-pyrrolidin-2-yl)methylcarbamoyl]-1H-pyrrole-2-carboxylate CAS Name: 3-ethyl-5-[(4-methoxyanilino)methyl]-4-[[(1-methyl-5-oxo-2-pyrrolidinyl)methylamino]-oxomethyl]-1H-pyrrole-2-carboxylic acid tert-butyl ester IUPAC Name: tert-butyl 3-ethyl-5-[(4-methoxyanilino)methyl]-4-[(1-methyl-5-oxopyrrolidin-2-yl)methylcarbamoyl]-1H-pyrrole-2-carboxylate Traditional Name: 3-ethyl-4-[(5-keto-1-methyl-pyrrolidin-2-yl)methylcarbamoyl]-5-(p-anisidinomethyl)-1H-pyrrole-2-carboxylic acid tert-butyl ester Formula: C26H36N4O5 MolecularWeight: 484.58784

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=C(NC(=C1C(=O)NCC2CCC(=O)N2C)CNC3=CC=C(C=C3)OC)C(=O)OC(C)(C)C

Isomeric SMILES

CCC1=C(NC(=C1C(=O)NCC2CCC(=O)N2C)CNC3=CC=C(C=C3)OC)C(=O)OC(C)(C)C

InChI

InChI=1S/C26H36N4O5/c1-7-19-22(24(32)28-14-17-10-13-21(31)30(17)5)20(29-23(19)25(33)35-26(2,3)4)15-27-16-8-11-18(34-6)12-9-16/h8-9,11-12,17,27,29H,7,10,13-15H2,1-6H3,(H,28,32)