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

Systemtic Name: ethyl 2,4-dimethyl-5-[[1-(2-oxidanylidene-2-phenylazanyl-ethyl)piperidin-4-yl]carbamoyl]-1H-pyrrole-3-carboxylate Openeye Name: ethyl 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 ethyl ester IUPAC Name: ethyl 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 ethyl ester Formula: C23H30N4O4 MolecularWeight: 426.5087

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(NC(=C1C)C(=O)NC2CCN(CC2)CC(=O)NC3=CC=CC=C3)C

Isomeric SMILES

CCOC(=O)C1=C(NC(=C1C)C(=O)NC2CCN(CC2)CC(=O)NC3=CC=CC=C3)C

InChI

InChI=1S/C23H30N4O4/c1-4-31-23(30)20-15(2)21(24-16(20)3)22(29)26-18-10-12-27(13-11-18)14-19(28)25-17-8-6-5-7-9-17/h5-9,18,24H,4,10-14H2,1-3H3,(H,25,28)(H,26,29)