ethyl 7-methylsulfonyloxy-3-(3-pyridin-3-ylpropyl)heptanoate

Systemtic Name: ethyl 7-methylsulfonyloxy-3-(3-pyridin-3-ylpropyl)heptanoate Openeye Name: ethyl 7-methylsulfonyloxy-3-[3-(3-pyridyl)propyl]heptanoate CAS Name: 7-methylsulfonyloxy-3-[3-(3-pyridinyl)propyl]heptanoic acid ethyl ester IUPAC Name: ethyl 7-methylsulfonyloxy-3-(3-pyridin-3-ylpropyl)heptanoate Traditional Name: 7-methylsulfonyloxy-3-[3-(3-pyridyl)propyl]enanthic acid ethyl ester Formula: C18H29NO5S MolecularWeight: 371.49156

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)CC(CCCCOS(=O)(=O)C)CCCC1=CN=CC=C1

Isomeric SMILES

CCOC(=O)CC(CCCCOS(=O)(=O)C)CCCC1=CN=CC=C1

InChI

InChI=1S/C18H29NO5S/c1-3-23-18(20)14-16(8-4-5-13-24-25(2,21)22)9-6-10-17-11-7-12-19-15-17/h7,11-12,15-16H,3-6,8-10,13-14H2,1-2H3