6-chloranyl-4-[(4-ethylpiperazin-4-ium-1-yl)methyl]-7-methyl-chromen-2-one

Systemtic Name: 6-chloranyl-4-[(4-ethylpiperazin-4-ium-1-yl)methyl]-7-methyl-chromen-2-one Openeye Name: 6-chloro-4-[(4-ethylpiperazin-4-ium-1-yl)methyl]-7-methyl-chromen-2-one CAS Name: 6-chloro-4-[(4-ethyl-1-piperazin-4-iumyl)methyl]-7-methyl-1-benzopyran-2-one IUPAC Name: 6-chloro-4-[(4-ethylpiperazin-4-ium-1-yl)methyl]-7-methylchromen-2-one Traditional Name: 6-chloro-4-[(4-ethylpiperazin-4-ium-1-yl)methyl]-7-methyl-coumarin Formula: C17H22ClN2O2+ MolecularWeight: 321.82178

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Descriptors Computed from Structure

Canonical SMILES:

CC[NH+]1CCN(CC1)CC2=CC(=O)OC3=CC(=C(C=C23)Cl)C

Isomeric SMILES

CC[NH+]1CCN(CC1)CC2=CC(=O)OC3=CC(=C(C=C23)Cl)C

InChI

InChI=1S/C17H21ClN2O2/c1-3-19-4-6-20(7-5-19)11-13-9-17(21)22-16-8-12(2)15(18)10-14(13)16/h8-10H,3-7,11H2,1-2H3/p+1