(5-methoxy-3-methyl-1-benzofuran-2-yl)-[4-[(3-methylphenyl)methyl]piperazin-4-ium-1-yl]methanone

Systemtic Name: (5-methoxy-3-methyl-1-benzofuran-2-yl)-[4-[(3-methylphenyl)methyl]piperazin-4-ium-1-yl]methanone Openeye Name: (5-methoxy-3-methyl-benzofuran-2-yl)-[4-(m-tolylmethyl)piperazin-4-ium-1-yl]methanone CAS Name: (5-methoxy-3-methyl-2-benzofuranyl)-[4-[(3-methylphenyl)methyl]-1-piperazin-4-iumyl]methanone IUPAC Name: (5-methoxy-3-methyl-1-benzofuran-2-yl)-[4-[(3-methylphenyl)methyl]piperazin-4-ium-1-yl]methanone Traditional Name: (5-methoxy-3-methyl-benzofuran-2-yl)-[4-(3-methylbenzyl)piperazin-4-ium-1-yl]methanone Formula: C23H27N2O3+ MolecularWeight: 379.47208

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC=C1)C[NH+]2CCN(CC2)C(=O)C3=C(C4=C(O3)C=CC(=C4)OC)C

Isomeric SMILES

CC1=CC(=CC=C1)C[NH+]2CCN(CC2)C(=O)C3=C(C4=C(O3)C=CC(=C4)OC)C

InChI

InChI=1S/C23H26N2O3/c1-16-5-4-6-18(13-16)15-24-9-11-25(12-10-24)23(26)22-17(2)20-14-19(27-3)7-8-21(20)28-22/h4-8,13-14H,9-12,15H2,1-3H3/p+1