ethyl 3,5-dimethyl-4-[4-[2-[(5-methylfuran-2-yl)methylamino]-2-oxidanylidene-ethyl]piperidin-1-yl]carbonyl-1H-pyrrole-2-carboxylate

Systemtic Name: ethyl 3,5-dimethyl-4-[4-[2-[(5-methylfuran-2-yl)methylamino]-2-oxidanylidene-ethyl]piperidin-1-yl]carbonyl-1H-pyrrole-2-carboxylate Openeye Name: ethyl 3,5-dimethyl-4-[4-[2-[(5-methyl-2-furyl)methylamino]-2-oxo-ethyl]piperidine-1-carbonyl]-1H-pyrrole-2-carboxylate CAS Name: 3,5-dimethyl-4-[[4-[2-[(5-methyl-2-furanyl)methylamino]-2-oxoethyl]-1-piperidinyl]-oxomethyl]-1H-pyrrole-2-carboxylic acid ethyl ester IUPAC Name: ethyl 3,5-dimethyl-4-[4-[2-[(5-methylfuran-2-yl)methylamino]-2-oxoethyl]piperidine-1-carbonyl]-1H-pyrrole-2-carboxylate Traditional Name: 4-[4-[2-keto-2-[(5-methyl-2-furyl)methylamino]ethyl]piperidine-1-carbonyl]-3,5-dimethyl-1H-pyrrole-2-carboxylic acid ethyl ester Formula: C23H31N3O5 MolecularWeight: 429.50934

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(C(=C(N1)C)C(=O)N2CCC(CC2)CC(=O)NCC3=CC=C(O3)C)C

Isomeric SMILES

CCOC(=O)C1=C(C(=C(N1)C)C(=O)N2CCC(CC2)CC(=O)NCC3=CC=C(O3)C)C

InChI

InChI=1S/C23H31N3O5/c1-5-30-23(29)21-15(3)20(16(4)25-21)22(28)26-10-8-17(9-11-26)12-19(27)24-13-18-7-6-14(2)31-18/h6-7,17,25H,5,8-13H2,1-4H3,(H,24,27)