2,3-dihydro-1H-inden-5-yl 2-[[[1-(3-piperidin-4-ylpropanoyl)piperidin-3-yl]carbonylamino]methyl]but-3-ynoate

Systemtic Name: 2,3-dihydro-1H-inden-5-yl 2-[[[1-(3-piperidin-4-ylpropanoyl)piperidin-3-yl]carbonylamino]methyl]but-3-ynoate Openeye Name: indan-5-yl 2-[[[1-[3-(4-piperidyl)propanoyl]piperidine-3-carbonyl]amino]methyl]but-3-ynoate CAS Name: 2-[[[oxo-[1-[1-oxo-3-(4-piperidinyl)propyl]-3-piperidinyl]methyl]amino]methyl]-3-butynoic acid 2,3-dihydro-1H-inden-5-yl ester IUPAC Name: 2,3-dihydro-1H-inden-5-yl 2-[[[1-(3-piperidin-4-ylpropanoyl)piperidine-3-carbonyl]amino]methyl]but-3-ynoate Traditional Name: 2-[[[1-[3-(4-piperidyl)propanoyl]nipecotoyl]amino]methyl]but-3-ynoic acid indan-5-yl ester Formula: C28H37N3O4 MolecularWeight: 479.61108

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Descriptors Computed from Structure

Canonical SMILES:

C#CC(CNC(=O)C1CCCN(C1)C(=O)CCC2CCNCC2)C(=O)OC3=CC4=C(CCC4)C=C3

Isomeric SMILES

C#CC(CNC(=O)C1CCCN(C1)C(=O)CCC2CCNCC2)C(=O)OC3=CC4=C(CCC4)C=C3

InChI

InChI=1S/C28H37N3O4/c1-2-21(28(34)35-25-10-9-22-5-3-6-23(22)17-25)18-30-27(33)24-7-4-16-31(19-24)26(32)11-8-20-12-14-29-15-13-20/h1,9-10,17,20-21,24,29H,3-8,11-16,18-19H2,(H,30,33)