(2,5-dimethoxyphenyl)-[4-[(4-propan-2-ylphenyl)methyl]piperazin-4-ium-1-yl]methanone

Systemtic Name: (2,5-dimethoxyphenyl)-[4-[(4-propan-2-ylphenyl)methyl]piperazin-4-ium-1-yl]methanone Openeye Name: (2,5-dimethoxyphenyl)-[4-[(4-isopropylphenyl)methyl]piperazin-4-ium-1-yl]methanone CAS Name: (2,5-dimethoxyphenyl)-[4-[(4-propan-2-ylphenyl)methyl]-1-piperazin-4-iumyl]methanone IUPAC Name: (2,5-dimethoxyphenyl)-[4-[(4-propan-2-ylphenyl)methyl]piperazin-4-ium-1-yl]methanone Traditional Name: (2,5-dimethoxyphenyl)-[4-(4-isopropylbenzyl)piperazin-4-ium-1-yl]methanone Formula: C23H31N2O3+ MolecularWeight: 383.50384

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C1=CC=C(C=C1)C[NH+]2CCN(CC2)C(=O)C3=C(C=CC(=C3)OC)OC

Isomeric SMILES

CC(C)C1=CC=C(C=C1)C[NH+]2CCN(CC2)C(=O)C3=C(C=CC(=C3)OC)OC

InChI

InChI=1S/C23H30N2O3/c1-17(2)19-7-5-18(6-8-19)16-24-11-13-25(14-12-24)23(26)21-15-20(27-3)9-10-22(21)28-4/h5-10,15,17H,11-14,16H2,1-4H3/p+1