4-ethyl-8-methyl-7-oxidanyl-6-[(4-phenylpiperazin-1-yl)methyl]chromen-2-one dihydrochloride

Systemtic Name: 4-ethyl-8-methyl-7-oxidanyl-6-[(4-phenylpiperazin-1-yl)methyl]chromen-2-one dihydrochloride Openeye Name: 4-ethyl-7-hydroxy-8-methyl-6-[(4-phenylpiperazin-1-yl)methyl]chromen-2-one dihydrochloride CAS Name: 4-ethyl-7-hydroxy-8-methyl-6-[(4-phenyl-1-piperazinyl)methyl]-1-benzopyran-2-one dihydrochloride IUPAC Name: 4-ethyl-7-hydroxy-8-methyl-6-[(4-phenylpiperazin-1-yl)methyl]chromen-2-one dihydrochloride Traditional Name: 4-ethyl-7-hydroxy-8-methyl-6-[(4-phenylpiperazino)methyl]coumarin dihydrochloride Formula: C23H28Cl2N2O3 MolecularWeight: 451.38602

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=CC(=O)OC2=C(C(=C(C=C12)CN3CCN(CC3)C4=CC=CC=C4)O)C.Cl.Cl

Isomeric SMILES

CCC1=CC(=O)OC2=C(C(=C(C=C12)CN3CCN(CC3)C4=CC=CC=C4)O)C.Cl.Cl

InChI

InChI=1S/C23H26N2O3.2ClH/c1-3-17-14-21(26)28-23-16(2)22(27)18(13-20(17)23)15-24-9-11-25(12-10-24)19-7-5-4-6-8-19;;/h4-8,13-14,27H,3,9-12,15H2,1-2H3;2*1H