methyl 2-ethyl-4-methyl-5-[4-(4-methylpiperidin-1-yl)butylcarbamoyl]-1H-pyrrole-3-carboxylate

Systemtic Name: methyl 2-ethyl-4-methyl-5-[4-(4-methylpiperidin-1-yl)butylcarbamoyl]-1H-pyrrole-3-carboxylate Openeye Name: methyl 2-ethyl-4-methyl-5-[4-(4-methyl-1-piperidyl)butylcarbamoyl]-1H-pyrrole-3-carboxylate CAS Name: 2-ethyl-4-methyl-5-[[4-(4-methyl-1-piperidinyl)butylamino]-oxomethyl]-1H-pyrrole-3-carboxylic acid methyl ester IUPAC Name: methyl 2-ethyl-4-methyl-5-[4-(4-methylpiperidin-1-yl)butylcarbamoyl]-1H-pyrrole-3-carboxylate Traditional Name: 2-ethyl-4-methyl-5-[4-(4-methylpiperidino)butylcarbamoyl]-1H-pyrrole-3-carboxylic acid methyl ester Formula: C20H33N3O3 MolecularWeight: 363.49432

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=C(C(=C(N1)C(=O)NCCCCN2CCC(CC2)C)C)C(=O)OC

Isomeric SMILES

CCC1=C(C(=C(N1)C(=O)NCCCCN2CCC(CC2)C)C)C(=O)OC

InChI

InChI=1S/C20H33N3O3/c1-5-16-17(20(25)26-4)15(3)18(22-16)19(24)21-10-6-7-11-23-12-8-14(2)9-13-23/h14,22H,5-13H2,1-4H3,(H,21,24)