2-ethoxy-6-[(E)-[4-(naphthalen-1-ylmethyl)piperazin-4-ium-1-yl]iminomethyl]phenolate

Systemtic Name: 2-ethoxy-6-[(E)-[4-(naphthalen-1-ylmethyl)piperazin-4-ium-1-yl]iminomethyl]phenolate Openeye Name: 2-ethoxy-6-[(E)-[4-(1-naphthylmethyl)piperazin-4-ium-1-yl]iminomethyl]phenolate CAS Name: 2-ethoxy-6-[(E)-[4-(1-naphthalenylmethyl)-1-piperazin-4-iumyl]iminomethyl]phenolate IUPAC Name: 2-ethoxy-6-[(E)-[4-(naphthalen-1-ylmethyl)piperazin-4-ium-1-yl]iminomethyl]phenolate Traditional Name: 2-ethoxy-6-[(E)-[4-(1-naphthylmethyl)piperazin-4-ium-1-yl]iminomethyl]phenolate Formula: C24H27N3O2 MolecularWeight: 389.49008

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=CC=CC(=C1[O-])C=NN2CC[NH+](CC2)CC3=CC=CC4=CC=CC=C43

Isomeric SMILES

CCOC1=CC=CC(=C1[O-])/C=N/N2CC[NH+](CC2)CC3=CC=CC4=CC=CC=C43

InChI

InChI=1S/C24H27N3O2/c1-2-29-23-12-6-9-20(24(23)28)17-25-27-15-13-26(14-16-27)18-21-10-5-8-19-7-3-4-11-22(19)21/h3-12,17,28H,2,13-16,18H2,1H3/b25-17+