7-(2-hydroxyethyl)-9a-methyl-3-octanoyl-6-[(E)-prop-1-enyl]furo[3,2-g]isoquinoline-2,9-dione

Systemtic Name: 7-(2-hydroxyethyl)-9a-methyl-3-octanoyl-6-[(E)-prop-1-enyl]furo[3,2-g]isoquinoline-2,9-dione Openeye Name: 7-(2-hydroxyethyl)-9a-methyl-3-octanoyl-6-[(E)-prop-1-enyl]furo[3,2-g]isoquinoline-2,9-dione CAS Name: 7-(2-hydroxyethyl)-9a-methyl-3-(1-oxooctyl)-6-[(E)-prop-1-enyl]furo[3,2-g]isoquinoline-2,9-dione IUPAC Name: 7-(2-hydroxyethyl)-9a-methyl-3-octanoyl-6-[(E)-prop-1-enyl]furo[3,2-g]isoquinoline-2,9-dione Traditional Name: 3-caprylyl-7-(2-hydroxyethyl)-9a-methyl-6-[(E)-prop-1-enyl]fur[3,2-g]isoquinoline-2,9-quinone Formula: C25H31NO5 MolecularWeight: 425.51734

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCC(=O)C1=C2C=C3C=C(N(C=C3C(=O)C2(OC1=O)C)CCO)C=CC

Isomeric SMILES

CCCCCCCC(=O)C1=C2C=C3C=C(N(C=C3C(=O)C2(OC1=O)C)CCO)/C=C/C

InChI

InChI=1S/C25H31NO5/c1-4-6-7-8-9-11-21(28)22-20-15-17-14-18(10-5-2)26(12-13-27)16-19(17)23(29)25(20,3)31-24(22)30/h5,10,14-16,27H,4,6-9,11-13H2,1-3H3/b10-5+