8-[(S)-(3-methoxyphenyl)-morpholin-4-ium-4-yl-methyl]-4-methyl-7-oxidanyl-benzo[h]chromen-2-one

Systemtic Name: 8-[(S)-(3-methoxyphenyl)-morpholin-4-ium-4-yl-methyl]-4-methyl-7-oxidanyl-benzo[h]chromen-2-one Openeye Name: 7-hydroxy-8-[(S)-(3-methoxyphenyl)-morpholin-4-ium-4-yl-methyl]-4-methyl-benzo[h]chromen-2-one CAS Name: 7-hydroxy-8-[(S)-(3-methoxyphenyl)-(4-morpholin-4-iumyl)methyl]-4-methyl-2-benzo[h][1]benzopyranone IUPAC Name: 7-hydroxy-8-[(S)-(3-methoxyphenyl)-morpholin-4-ium-4-ylmethyl]-4-methylbenzo[h]chromen-2-one Traditional Name: 7-hydroxy-8-[(S)-(3-methoxyphenyl)-morpholin-4-ium-4-yl-methyl]-4-methyl-benzo[h]chromen-2-one Formula: C26H26NO5+ MolecularWeight: 432.48834

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=O)OC2=C1C=CC3=C2C=CC(=C3O)C(C4=CC(=CC=C4)OC)[NH+]5CCOCC5

Isomeric SMILES

CC1=CC(=O)OC2=C1C=CC3=C2C=CC(=C3O)[C@H](C4=CC(=CC=C4)OC)[NH+]5CCOCC5

InChI

InChI=1S/C26H25NO5/c1-16-14-23(28)32-26-19(16)6-7-20-21(26)8-9-22(25(20)29)24(27-10-12-31-13-11-27)17-4-3-5-18(15-17)30-2/h3-9,14-15,24,29H,10-13H2,1-2H3/p+1/t24-/m0/s1