ethyl (3S)-1-[3-[2-methoxyethyl-(2-methylfuran-3-yl)carbonyl-amino]propanoyl]piperidine-3-carboxylate

Systemtic Name: ethyl (3S)-1-[3-[2-methoxyethyl-(2-methylfuran-3-yl)carbonyl-amino]propanoyl]piperidine-3-carboxylate Openeye Name: ethyl (3S)-1-[3-[2-methoxyethyl-(2-methylfuran-3-carbonyl)amino]propanoyl]piperidine-3-carboxylate CAS Name: (3S)-1-[3-[2-methoxyethyl-[(2-methyl-3-furanyl)-oxomethyl]amino]-1-oxopropyl]-3-piperidinecarboxylic acid ethyl ester IUPAC Name: ethyl (3S)-1-[3-[2-methoxyethyl-(2-methylfuran-3-carbonyl)amino]propanoyl]piperidine-3-carboxylate Traditional Name: (3S)-1-[3-[2-methoxyethyl-(2-methyl-3-furoyl)amino]propanoyl]nipecotic acid ethyl ester Formula: C20H30N2O6 MolecularWeight: 394.462

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1CCCN(C1)C(=O)CCN(CCOC)C(=O)C2=C(OC=C2)C

Isomeric SMILES

CCOC(=O)[C@H]1CCCN(C1)C(=O)CCN(CCOC)C(=O)C2=C(OC=C2)C

InChI

InChI=1S/C20H30N2O6/c1-4-27-20(25)16-6-5-9-22(14-16)18(23)7-10-21(11-13-26-3)19(24)17-8-12-28-15(17)2/h8,12,16H,4-7,9-11,13-14H2,1-3H3/t16-/m0/s1