(3-oxidanylnaphthalen-2-yl)-[4-(phenylmethyl)piperazin-4-ium-1-yl]methanone

Systemtic Name: (3-oxidanylnaphthalen-2-yl)-[4-(phenylmethyl)piperazin-4-ium-1-yl]methanone Openeye Name: (4-benzylpiperazin-4-ium-1-yl)-(3-hydroxy-2-naphthyl)methanone CAS Name: (3-hydroxy-2-naphthalenyl)-[4-(phenylmethyl)-1-piperazin-4-iumyl]methanone IUPAC Name: (4-benzylpiperazin-4-ium-1-yl)-(3-hydroxynaphthalen-2-yl)methanone Traditional Name: (4-benzylpiperazin-4-ium-1-yl)-(3-hydroxy-2-naphthyl)methanone Formula: C22H23N2O2+ MolecularWeight: 347.43022

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CC[NH+]1CC2=CC=CC=C2)C(=O)C3=CC4=CC=CC=C4C=C3O

Isomeric SMILES

C1CN(CC[NH+]1CC2=CC=CC=C2)C(=O)C3=CC4=CC=CC=C4C=C3O

InChI

InChI=1S/C22H22N2O2/c25-21-15-19-9-5-4-8-18(19)14-20(21)22(26)24-12-10-23(11-13-24)16-17-6-2-1-3-7-17/h1-9,14-15,25H,10-13,16H2/p+1