ethyl 3-[[1-(2-piperidin-4-yloxyethanoyl)piperidin-3-yl]carbonylamino]pent-4-ynoate

Systemtic Name: ethyl 3-[[1-(2-piperidin-4-yloxyethanoyl)piperidin-3-yl]carbonylamino]pent-4-ynoate Openeye Name: ethyl 3-[[1-[2-(4-piperidyloxy)acetyl]piperidine-3-carbonyl]amino]pent-4-ynoate CAS Name: 3-[[oxo-[1-[1-oxo-2-(4-piperidinyloxy)ethyl]-3-piperidinyl]methyl]amino]-4-pentynoic acid ethyl ester IUPAC Name: ethyl 3-[[1-(2-piperidin-4-yloxyacetyl)piperidine-3-carbonyl]amino]pent-4-ynoate Traditional Name: 3-[[1-[2-(4-piperidyloxy)acetyl]nipecotoyl]amino]pent-4-ynoic acid ethyl ester Formula: C20H31N3O5 MolecularWeight: 393.47724

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)CC(C#C)NC(=O)C1CCCN(C1)C(=O)COC2CCNCC2

Isomeric SMILES

CCOC(=O)CC(C#C)NC(=O)C1CCCN(C1)C(=O)COC2CCNCC2

InChI

InChI=1S/C20H31N3O5/c1-3-16(12-19(25)27-4-2)22-20(26)15-6-5-11-23(13-15)18(24)14-28-17-7-9-21-10-8-17/h1,15-17,21H,4-14H2,2H3,(H,22,26)