[4-[(2,5-dimethoxyphenyl)methyl]piperazin-4-ium-1-yl]-(3-oxidanylnaphthalen-2-yl)methanone

Systemtic Name: [4-[(2,5-dimethoxyphenyl)methyl]piperazin-4-ium-1-yl]-(3-oxidanylnaphthalen-2-yl)methanone Openeye Name: [4-[(2,5-dimethoxyphenyl)methyl]piperazin-4-ium-1-yl]-(3-hydroxy-2-naphthyl)methanone CAS Name: [4-[(2,5-dimethoxyphenyl)methyl]-1-piperazin-4-iumyl]-(3-hydroxy-2-naphthalenyl)methanone IUPAC Name: [4-[(2,5-dimethoxyphenyl)methyl]piperazin-4-ium-1-yl]-(3-hydroxynaphthalen-2-yl)methanone Traditional Name: [4-(2,5-dimethoxybenzyl)piperazin-4-ium-1-yl]-(3-hydroxy-2-naphthyl)methanone Formula: C24H27N2O4+ MolecularWeight: 407.48218

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC(=C(C=C1)OC)C[NH+]2CCN(CC2)C(=O)C3=CC4=CC=CC=C4C=C3O

Isomeric SMILES

COC1=CC(=C(C=C1)OC)C[NH+]2CCN(CC2)C(=O)C3=CC4=CC=CC=C4C=C3O

InChI

InChI=1S/C24H26N2O4/c1-29-20-7-8-23(30-2)19(13-20)16-25-9-11-26(12-10-25)24(28)21-14-17-5-3-4-6-18(17)15-22(21)27/h3-8,13-15,27H,9-12,16H2,1-2H3/p+1