3-[(4-ethylpiperazin-4-ium-1-yl)methyl]-2-methyl-1H-benzo[h]quinolin-4-one

Systemtic Name: 3-[(4-ethylpiperazin-4-ium-1-yl)methyl]-2-methyl-1H-benzo[h]quinolin-4-one Openeye Name: 3-[(4-ethylpiperazin-4-ium-1-yl)methyl]-2-methyl-1H-benzo[h]quinolin-4-one CAS Name: 3-[(4-ethyl-1-piperazin-4-iumyl)methyl]-2-methyl-1H-benzo[h]quinolin-4-one IUPAC Name: 3-[(4-ethylpiperazin-4-ium-1-yl)methyl]-2-methyl-1H-benzo[h]quinolin-4-one Traditional Name: 3-[(4-ethylpiperazin-4-ium-1-yl)methyl]-2-methyl-1H-benzo[h]quinolin-4-one Formula: C21H26N3O+ MolecularWeight: 336.45064

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Descriptors Computed from Structure

Canonical SMILES:

CC[NH+]1CCN(CC1)CC2=C(NC3=C(C2=O)C=CC4=CC=CC=C43)C

Isomeric SMILES

CC[NH+]1CCN(CC1)CC2=C(NC3=C(C2=O)C=CC4=CC=CC=C43)C

InChI

InChI=1S/C21H25N3O/c1-3-23-10-12-24(13-11-23)14-19-15(2)22-20-17-7-5-4-6-16(17)8-9-18(20)21(19)25/h4-9H,3,10-14H2,1-2H3,(H,22,25)/p+1