ethyl 2-[[3-[2-(4-carbamimidoylphenoxy)-4-methyl-quinolin-7-yl]-4-methyl-phenyl]carbonylamino]ethanoate

Systemtic Name: ethyl 2-[[3-[2-(4-carbamimidoylphenoxy)-4-methyl-quinolin-7-yl]-4-methyl-phenyl]carbonylamino]ethanoate Openeye Name: ethyl 2-[[3-[2-(4-carbamimidoylphenoxy)-4-methyl-7-quinolyl]-4-methyl-benzoyl]amino]acetate CAS Name: 2-[[[3-[2-(4-carbamimidoylphenoxy)-4-methyl-7-quinolinyl]-4-methylphenyl]-oxomethyl]amino]acetic acid ethyl ester IUPAC Name: ethyl 2-[[3-[2-(4-carbamimidoylphenoxy)-4-methylquinolin-7-yl]-4-methylbenzoyl]amino]acetate Traditional Name: 2-[[3-[2-(4-amidinophenoxy)-4-methyl-7-quinolyl]-4-methyl-benzoyl]amino]acetic acid ethyl ester Formula: C29H28N4O4 MolecularWeight: 496.55702

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)CNC(=O)C1=CC(=C(C=C1)C)C2=CC3=C(C=C2)C(=CC(=N3)OC4=CC=C(C=C4)C(=N)N)C

Isomeric SMILES

CCOC(=O)CNC(=O)C1=CC(=C(C=C1)C)C2=CC3=C(C=C2)C(=CC(=N3)OC4=CC=C(C=C4)C(=N)N)C

InChI

InChI=1S/C29H28N4O4/c1-4-36-27(34)16-32-29(35)21-6-5-17(2)24(14-21)20-9-12-23-18(3)13-26(33-25(23)15-20)37-22-10-7-19(8-11-22)28(30)31/h5-15H,4,16H2,1-3H3,(H3,30,31)(H,32,35)