1-[(E)-[4-(2-methoxyphenyl)piperazin-4-ium-1-yl]iminomethyl]naphthalen-2-olate

Systemtic Name: 1-[(E)-[4-(2-methoxyphenyl)piperazin-4-ium-1-yl]iminomethyl]naphthalen-2-olate Openeye Name: 1-[(E)-[4-(2-methoxyphenyl)piperazin-4-ium-1-yl]iminomethyl]naphthalen-2-olate CAS Name: 1-[(E)-[4-(2-methoxyphenyl)-1-piperazin-4-iumyl]iminomethyl]-2-naphthalenolate IUPAC Name: 1-[(E)-[4-(2-methoxyphenyl)piperazin-4-ium-1-yl]iminomethyl]naphthalen-2-olate Traditional Name: 1-[(E)-[4-(2-methoxyphenyl)piperazin-4-ium-1-yl]iminomethyl]naphthalen-2-olate Formula: C22H23N3O2 MolecularWeight: 361.43692

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=CC=C1[NH+]2CCN(CC2)N=CC3=C(C=CC4=CC=CC=C43)[O-]

Isomeric SMILES

COC1=CC=CC=C1[NH+]2CCN(CC2)/N=C/C3=C(C=CC4=CC=CC=C43)[O-]

InChI

InChI=1S/C22H23N3O2/c1-27-22-9-5-4-8-20(22)24-12-14-25(15-13-24)23-16-19-18-7-3-2-6-17(18)10-11-21(19)26/h2-11,16,26H,12-15H2,1H3/b23-16+