2-[[3-[2-(4-carbamimidoylphenoxy)-4-methyl-quinolin-7-yl]-4-methyl-phenyl]carbonylamino]ethanoic acid

Systemtic Name: 2-[[3-[2-(4-carbamimidoylphenoxy)-4-methyl-quinolin-7-yl]-4-methyl-phenyl]carbonylamino]ethanoic acid Openeye Name: 2-[[3-[2-(4-carbamimidoylphenoxy)-4-methyl-7-quinolyl]-4-methyl-benzoyl]amino]acetic acid CAS Name: 2-[[[3-[2-(4-carbamimidoylphenoxy)-4-methyl-7-quinolinyl]-4-methylphenyl]-oxomethyl]amino]acetic acid IUPAC Name: 2-[[3-[2-(4-carbamimidoylphenoxy)-4-methylquinolin-7-yl]-4-methylbenzoyl]amino]acetic acid Traditional Name: 2-[[3-[2-(4-amidinophenoxy)-4-methyl-7-quinolyl]-4-methyl-benzoyl]amino]acetic acid Formula: C27H24N4O4 MolecularWeight: 468.50386

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)C(=O)NCC(=O)O)C2=CC3=C(C=C2)C(=CC(=N3)OC4=CC=C(C=C4)C(=N)N)C

Isomeric SMILES

CC1=C(C=C(C=C1)C(=O)NCC(=O)O)C2=CC3=C(C=C2)C(=CC(=N3)OC4=CC=C(C=C4)C(=N)N)C

InChI

InChI=1S/C27H24N4O4/c1-15-3-4-19(27(34)30-14-25(32)33)12-22(15)18-7-10-21-16(2)11-24(31-23(21)13-18)35-20-8-5-17(6-9-20)26(28)29/h3-13H,14H2,1-2H3,(H3,28,29)(H,30,34)(H,32,33)