5-chloranyl-3-[[4-(diphenylmethyl)piperazine-1,4-diium-1-yl]methyl]-8-methoxy-2-methyl-1H-quinolin-4-one

Systemtic Name: 5-chloranyl-3-[[4-(diphenylmethyl)piperazine-1,4-diium-1-yl]methyl]-8-methoxy-2-methyl-1H-quinolin-4-one Openeye Name: 3-[(4-benzhydrylpiperazine-1,4-diium-1-yl)methyl]-5-chloro-8-methoxy-2-methyl-1H-quinolin-4-one CAS Name: 5-chloro-3-[[4-(diphenylmethyl)-1-piperazine-1,4-diiumyl]methyl]-8-methoxy-2-methyl-1H-quinolin-4-one IUPAC Name: 3-[(4-benzhydrylpiperazine-1,4-diium-1-yl)methyl]-5-chloro-8-methoxy-2-methyl-1H-quinolin-4-one Traditional Name: 3-[(4-benzhydrylpiperazine-1,4-diium-1-yl)methyl]-5-chloro-8-methoxy-2-methyl-4-quinolone Formula: C29H32ClN3O2+2 MolecularWeight: 490.03628

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=O)C2=C(C=CC(=C2N1)OC)Cl)C[NH+]3CC[NH+](CC3)C(C4=CC=CC=C4)C5=CC=CC=C5

Isomeric SMILES

CC1=C(C(=O)C2=C(C=CC(=C2N1)OC)Cl)C[NH+]3CC[NH+](CC3)C(C4=CC=CC=C4)C5=CC=CC=C5

InChI

InChI=1S/C29H30ClN3O2/c1-20-23(29(34)26-24(30)13-14-25(35-2)27(26)31-20)19-32-15-17-33(18-16-32)28(21-9-5-3-6-10-21)22-11-7-4-8-12-22/h3-14,28H,15-19H2,1-2H3,(H,31,34)/p+2