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

Systemtic Name: ethyl 3,5-dimethyl-4-[[1-(2-oxidanylidene-2-phenylazanyl-ethyl)piperidin-4-yl]carbamoyl]-1H-pyrrole-2-carboxylate Openeye Name: ethyl 4-[[1-(2-anilino-2-oxo-ethyl)-4-piperidyl]carbamoyl]-3,5-dimethyl-1H-pyrrole-2-carboxylate CAS Name: 4-[[[1-(2-anilino-2-oxoethyl)-4-piperidinyl]amino]-oxomethyl]-3,5-dimethyl-1H-pyrrole-2-carboxylic acid ethyl ester IUPAC Name: ethyl 4-[[1-(2-anilino-2-oxoethyl)piperidin-4-yl]carbamoyl]-3,5-dimethyl-1H-pyrrole-2-carboxylate Traditional Name: 4-[[1-(2-anilino-2-keto-ethyl)-4-piperidyl]carbamoyl]-3,5-dimethyl-1H-pyrrole-2-carboxylic acid ethyl ester Formula: C23H30N4O4 MolecularWeight: 426.5087

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(C(=C(N1)C)C(=O)NC2CCN(CC2)CC(=O)NC3=CC=CC=C3)C

Isomeric SMILES

CCOC(=O)C1=C(C(=C(N1)C)C(=O)NC2CCN(CC2)CC(=O)NC3=CC=CC=C3)C

InChI

InChI=1S/C23H30N4O4/c1-4-31-23(30)21-15(2)20(16(3)24-21)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)