3-ethyl-7-methoxy-8-(morpholin-4-ium-4-ylmethyl)-2-phenyl-chromen-4-one chloride

Systemtic Name: 3-ethyl-7-methoxy-8-(morpholin-4-ium-4-ylmethyl)-2-phenyl-chromen-4-one chloride Openeye Name: 3-ethyl-7-methoxy-8-(morpholin-4-ium-4-ylmethyl)-2-phenyl-chromen-4-one chloride CAS Name: 3-ethyl-7-methoxy-8-(4-morpholin-4-iumylmethyl)-2-phenyl-1-benzopyran-4-one chloride IUPAC Name: 3-ethyl-7-methoxy-8-(morpholin-4-ium-4-ylmethyl)-2-phenylchromen-4-one chloride Traditional Name: 3-ethyl-7-methoxy-8-(morpholin-4-ium-4-ylmethyl)-2-phenyl-chromone chloride Formula: C23H26ClNO4 MolecularWeight: 415.90984

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=C(OC2=C(C1=O)C=CC(=C2C[NH+]3CCOCC3)OC)C4=CC=CC=C4.[Cl-]

Isomeric SMILES

CCC1=C(OC2=C(C1=O)C=CC(=C2C[NH+]3CCOCC3)OC)C4=CC=CC=C4.[Cl-]

InChI

InChI=1S/C23H25NO4.ClH/c1-3-17-21(25)18-9-10-20(26-2)19(15-24-11-13-27-14-12-24)23(18)28-22(17)16-7-5-4-6-8-16;/h4-10H,3,11-15H2,1-2H3;1H