5-(diethylazaniumyl)-2-(2,3-dihydro-1H-perimidin-2-yl)phenolate

Systemtic Name: 5-(diethylazaniumyl)-2-(2,3-dihydro-1H-perimidin-2-yl)phenolate Openeye Name: 5-(diethylammonio)-2-(2,3-dihydro-1H-perimidin-2-yl)phenolate CAS Name: 5-(diethylammonio)-2-(2,3-dihydro-1H-perimidin-2-yl)phenolate IUPAC Name: 5-(diethylazaniumyl)-2-(2,3-dihydro-1H-perimidin-2-yl)phenolate Traditional Name: 5-(diethylammonio)-2-(2,3-dihydro-1H-perimidin-2-yl)phenolate Formula: C21H23N3O MolecularWeight: 333.42682

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Descriptors Computed from Structure

Canonical SMILES:

CC[NH+](CC)C1=CC(=C(C=C1)C2NC3=CC=CC4=C3C(=CC=C4)N2)[O-]

Isomeric SMILES

CC[NH+](CC)C1=CC(=C(C=C1)C2NC3=CC=CC4=C3C(=CC=C4)N2)[O-]

InChI

InChI=1S/C21H23N3O/c1-3-24(4-2)15-11-12-16(19(25)13-15)21-22-17-9-5-7-14-8-6-10-18(23-21)20(14)17/h5-13,21-23,25H,3-4H2,1-2H3