methyl 2-ethyl-4-methyl-5-[4-[oxidanyl(phenyl)methyl]piperidin-1-yl]carbonyl-1H-pyrrole-3-carboxylate

Systemtic Name: methyl 2-ethyl-4-methyl-5-[4-[oxidanyl(phenyl)methyl]piperidin-1-yl]carbonyl-1H-pyrrole-3-carboxylate Openeye Name: methyl 2-ethyl-5-[4-[hydroxy(phenyl)methyl]piperidine-1-carbonyl]-4-methyl-1H-pyrrole-3-carboxylate CAS Name: 2-ethyl-5-[[4-[hydroxy(phenyl)methyl]-1-piperidinyl]-oxomethyl]-4-methyl-1H-pyrrole-3-carboxylic acid methyl ester IUPAC Name: methyl 2-ethyl-5-[4-[hydroxy(phenyl)methyl]piperidine-1-carbonyl]-4-methyl-1H-pyrrole-3-carboxylate Traditional Name: 2-ethyl-5-[4-[hydroxy(phenyl)methyl]piperidine-1-carbonyl]-4-methyl-1H-pyrrole-3-carboxylic acid methyl ester Formula: C22H28N2O4 MolecularWeight: 384.46872

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=C(C(=C(N1)C(=O)N2CCC(CC2)C(C3=CC=CC=C3)O)C)C(=O)OC

Isomeric SMILES

CCC1=C(C(=C(N1)C(=O)N2CCC(CC2)C(C3=CC=CC=C3)O)C)C(=O)OC

InChI

InChI=1S/C22H28N2O4/c1-4-17-18(22(27)28-3)14(2)19(23-17)21(26)24-12-10-16(11-13-24)20(25)15-8-6-5-7-9-15/h5-9,16,20,23,25H,4,10-13H2,1-3H3