7-chloranyl-2,8-dimethyl-3-[[4-(phenylmethyl)piperazine-1,4-diium-1-yl]methyl]-1H-quinolin-4-one

Systemtic Name: 7-chloranyl-2,8-dimethyl-3-[[4-(phenylmethyl)piperazine-1,4-diium-1-yl]methyl]-1H-quinolin-4-one Openeye Name: 3-[(4-benzylpiperazine-1,4-diium-1-yl)methyl]-7-chloro-2,8-dimethyl-1H-quinolin-4-one CAS Name: 7-chloro-2,8-dimethyl-3-[[4-(phenylmethyl)-1-piperazine-1,4-diiumyl]methyl]-1H-quinolin-4-one IUPAC Name: 3-[(4-benzylpiperazine-1,4-diium-1-yl)methyl]-7-chloro-2,8-dimethyl-1H-quinolin-4-one Traditional Name: 3-[(4-benzylpiperazine-1,4-diium-1-yl)methyl]-7-chloro-2,8-dimethyl-4-quinolone Formula: C23H28ClN3O+2 MolecularWeight: 397.94092

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=CC2=C1NC(=C(C2=O)C[NH+]3CC[NH+](CC3)CC4=CC=CC=C4)C)Cl

Isomeric SMILES

CC1=C(C=CC2=C1NC(=C(C2=O)C[NH+]3CC[NH+](CC3)CC4=CC=CC=C4)C)Cl

InChI

InChI=1S/C23H26ClN3O/c1-16-21(24)9-8-19-22(16)25-17(2)20(23(19)28)15-27-12-10-26(11-13-27)14-18-6-4-3-5-7-18/h3-9H,10-15H2,1-2H3,(H,25,28)/p+2