(3-pyridin-4-yl-2,4-dioxaspiro[5.10]hexadecan-16-yl) prop-2-enoate

Systemtic Name: (3-pyridin-4-yl-2,4-dioxaspiro[5.10]hexadecan-16-yl) prop-2-enoate Openeye Name: [3-(4-pyridyl)-2,4-dioxaspiro[5.10]hexadecan-16-yl] prop-2-enoate CAS Name: 2-propenoic acid (3-pyridin-4-yl-2,4-dioxaspiro[5.10]hexadecan-16-yl) ester IUPAC Name: (3-pyridin-4-yl-2,4-dioxaspiro[5.10]hexadecan-16-yl) prop-2-enoate Traditional Name: acrylic acid [3-(4-pyridyl)-2,4-dioxaspiro[5.10]hexadecan-16-yl] ester Formula: C22H31NO4 MolecularWeight: 373.48584

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C=CC(=O)OC1CCCCCCCCCC12COC(OC2)C3=CC=NC=C3

Isomeric SMILES

C=CC(=O)OC1CCCCCCCCCC12COC(OC2)C3=CC=NC=C3

InChI

InChI=1S/C22H31NO4/c1-2-20(24)27-19-10-8-6-4-3-5-7-9-13-22(19)16-25-21(26-17-22)18-11-14-23-15-12-18/h2,11-12,14-15,19,21H,1,3-10,13,16-17H2