2-methyl-4-[4-(phenylmethyl)piperazin-1-yl]quinolin-1-ium

Systemtic Name: 2-methyl-4-[4-(phenylmethyl)piperazin-1-yl]quinolin-1-ium Openeye Name: 4-(4-benzylpiperazin-1-yl)-2-methyl-quinolin-1-ium CAS Name: 2-methyl-4-[4-(phenylmethyl)-1-piperazinyl]quinolin-1-ium IUPAC Name: 4-(4-benzylpiperazin-1-yl)-2-methylquinolin-1-ium Traditional Name: 4-(4-benzylpiperazino)-2-methyl-quinolin-1-ium Formula: C21H24N3+ MolecularWeight: 318.43536

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Descriptors Computed from Structure

Canonical SMILES:

CC1=[NH+]C2=CC=CC=C2C(=C1)N3CCN(CC3)CC4=CC=CC=C4

Isomeric SMILES

CC1=[NH+]C2=CC=CC=C2C(=C1)N3CCN(CC3)CC4=CC=CC=C4

InChI

InChI=1S/C21H23N3/c1-17-15-21(19-9-5-6-10-20(19)22-17)24-13-11-23(12-14-24)16-18-7-3-2-4-8-18/h2-10,15H,11-14,16H2,1H3/p+1