methyl 2,4-dimethyl-5-[[1-(2-oxidanylidene-2-phenylazanyl-ethyl)piperidin-4-yl]carbamoyl]-1H-pyrrole-3-carboxylate

Systemtic Name: methyl 2,4-dimethyl-5-[[1-(2-oxidanylidene-2-phenylazanyl-ethyl)piperidin-4-yl]carbamoyl]-1H-pyrrole-3-carboxylate Openeye Name: methyl 5-[[1-(2-anilino-2-oxo-ethyl)-4-piperidyl]carbamoyl]-2,4-dimethyl-1H-pyrrole-3-carboxylate CAS Name: 5-[[[1-(2-anilino-2-oxoethyl)-4-piperidinyl]amino]-oxomethyl]-2,4-dimethyl-1H-pyrrole-3-carboxylic acid methyl ester IUPAC Name: methyl 5-[[1-(2-anilino-2-oxoethyl)piperidin-4-yl]carbamoyl]-2,4-dimethyl-1H-pyrrole-3-carboxylate Traditional Name: 5-[[1-(2-anilino-2-keto-ethyl)-4-piperidyl]carbamoyl]-2,4-dimethyl-1H-pyrrole-3-carboxylic acid methyl ester Formula: C22H28N4O4 MolecularWeight: 412.48212

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(NC(=C1C(=O)OC)C)C(=O)NC2CCN(CC2)CC(=O)NC3=CC=CC=C3

Isomeric SMILES

CC1=C(NC(=C1C(=O)OC)C)C(=O)NC2CCN(CC2)CC(=O)NC3=CC=CC=C3

InChI

InChI=1S/C22H28N4O4/c1-14-19(22(29)30-3)15(2)23-20(14)21(28)25-17-9-11-26(12-10-17)13-18(27)24-16-7-5-4-6-8-16/h4-8,17,23H,9-13H2,1-3H3,(H,24,27)(H,25,28)