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1-(3-chlorophenyl)-4-[(4-methoxy-2,3-dimethyl-phenyl)methyl]piperazin-4-ium
1-(3-chlorophenyl)-4-[(4-methoxy-2,3-dimethyl-phenyl)methyl]piperazin-4-ium
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Descriptors Computed from Structure
Canonical SMILES:
CC1=C(C=CC(=C1C)OC)C[NH+]2CCN(CC2)C3=CC(=CC=C3)Cl
Isomeric SMILES
CC1=C(C=CC(=C1C)OC)C[NH+]2CCN(CC2)C3=CC(=CC=C3)Cl
InChI
InChI=1S/C20H25ClN2O/c1-15-16(2)20(24-3)8-7-17(15)14-22-9-11-23(12-10-22)19-6-4-5-18(21)13-19/h4-8,13H,9-12,14H2,1-3H3/p+1
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- methyl (2R)-2-[(4-methyl-2,6-dinitro-phenyl)amino]-4-methylsulfanyl-butanoate
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- 1-(2-chloranyl-4-nitro-phenyl)-4-(phenylmethyl)piperazin-4-ium
