3-(2-ethoxyphenoxy)-2-methyl-8-(morpholin-4-ium-4-ylmethyl)-4-oxidanyl-5,6,8,8a-tetrahydrochromen-7-one

Systemtic Name: 3-(2-ethoxyphenoxy)-2-methyl-8-(morpholin-4-ium-4-ylmethyl)-4-oxidanyl-5,6,8,8a-tetrahydrochromen-7-one Openeye Name: 3-(2-ethoxyphenoxy)-4-hydroxy-2-methyl-8-(morpholin-4-ium-4-ylmethyl)-5,6,8,8a-tetrahydrochromen-7-one CAS Name: 3-(2-ethoxyphenoxy)-4-hydroxy-2-methyl-8-(4-morpholin-4-iumylmethyl)-5,6,8,8a-tetrahydro-1-benzopyran-7-one IUPAC Name: 3-(2-ethoxyphenoxy)-4-hydroxy-2-methyl-8-(morpholin-4-ium-4-ylmethyl)-5,6,8,8a-tetrahydrochromen-7-one Traditional Name: 3-(2-ethoxyphenoxy)-4-hydroxy-2-methyl-8-(morpholin-4-ium-4-ylmethyl)-5,6,8,8a-tetrahydrochromen-7-one Formula: C23H30NO6+ MolecularWeight: 416.4874

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=CC=CC=C1OC2=C(OC3C(C(=O)CCC3=C2O)C[NH+]4CCOCC4)C

Isomeric SMILES

CCOC1=CC=CC=C1OC2=C(OC3C(C(=O)CCC3=C2O)C[NH+]4CCOCC4)C

InChI

InChI=1S/C23H29NO6/c1-3-28-19-6-4-5-7-20(19)30-22-15(2)29-23-16(21(22)26)8-9-18(25)17(23)14-24-10-12-27-13-11-24/h4-7,17,23,26H,3,8-14H2,1-2H3/p+1