3-[[6-(3-carbamimidoylphenoxy)-4-methyl-2-oxidanylidene-quinolin-1-yl]methyl]benzenecarboximidamide

Systemtic Name: 3-[[6-(3-carbamimidoylphenoxy)-4-methyl-2-oxidanylidene-quinolin-1-yl]methyl]benzenecarboximidamide Openeye Name: 3-[[6-(3-carbamimidoylphenoxy)-4-methyl-2-oxo-1-quinolyl]methyl]benzamidine CAS Name: 3-[[6-(3-carbamimidoylphenoxy)-4-methyl-2-oxo-1-quinolinyl]methyl]benzenecarboximidamide IUPAC Name: 3-[[6-(3-carbamimidoylphenoxy)-4-methyl-2-oxoquinolin-1-yl]methyl]benzenecarboximidamide Traditional Name: 3-[[6-(3-amidinophenoxy)-2-keto-4-methyl-1-quinolyl]methyl]benzamidine Formula: C25H23N5O2 MolecularWeight: 425.48242

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=O)N(C2=C1C=C(C=C2)OC3=CC=CC(=C3)C(=N)N)CC4=CC=CC(=C4)C(=N)N

Isomeric SMILES

CC1=CC(=O)N(C2=C1C=C(C=C2)OC3=CC=CC(=C3)C(=N)N)CC4=CC=CC(=C4)C(=N)N

InChI

InChI=1S/C25H23N5O2/c1-15-10-23(31)30(14-16-4-2-5-17(11-16)24(26)27)22-9-8-20(13-21(15)22)32-19-7-3-6-18(12-19)25(28)29/h2-13H,14H2,1H3,(H3,26,27)(H3,28,29)