ethyl 2-methyl-1-[3-(3-methylpiperidin-1-yl)-3-oxidanylidene-propyl]-5-phenyl-pyrrole-3-carboxylate

Systemtic Name: ethyl 2-methyl-1-[3-(3-methylpiperidin-1-yl)-3-oxidanylidene-propyl]-5-phenyl-pyrrole-3-carboxylate Openeye Name: ethyl 2-methyl-1-[3-(3-methyl-1-piperidyl)-3-oxo-propyl]-5-phenyl-pyrrole-3-carboxylate CAS Name: 2-methyl-1-[3-(3-methyl-1-piperidinyl)-3-oxopropyl]-5-phenyl-3-pyrrolecarboxylic acid ethyl ester IUPAC Name: ethyl 2-methyl-1-[3-(3-methylpiperidin-1-yl)-3-oxopropyl]-5-phenylpyrrole-3-carboxylate Traditional Name: 1-[3-keto-3-(3-methylpiperidino)propyl]-2-methyl-5-phenyl-pyrrole-3-carboxylic acid ethyl ester Formula: C23H30N2O3 MolecularWeight: 382.4959

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(N(C(=C1)C2=CC=CC=C2)CCC(=O)N3CCCC(C3)C)C

Isomeric SMILES

CCOC(=O)C1=C(N(C(=C1)C2=CC=CC=C2)CCC(=O)N3CCCC(C3)C)C

InChI

InChI=1S/C23H30N2O3/c1-4-28-23(27)20-15-21(19-10-6-5-7-11-19)25(18(20)3)14-12-22(26)24-13-8-9-17(2)16-24/h5-7,10-11,15,17H,4,8-9,12-14,16H2,1-3H3