O1-(2-methoxyethoxymethyl) O3-methyl 4-[2-[(4-carbamimidoylphenyl)carbamoyl]-4-phenylmethoxy-phenyl]benzene-1,3-dicarboxylate

Systemtic Name: O1-(2-methoxyethoxymethyl) O3-methyl 4-[2-[(4-carbamimidoylphenyl)carbamoyl]-4-phenylmethoxy-phenyl]benzene-1,3-dicarboxylate Openeye Name: O1-(2-methoxyethoxymethyl) O3-methyl 4-[4-benzyloxy-2-[(4-carbamimidoylphenyl)carbamoyl]phenyl]benzene-1,3-dicarboxylate CAS Name: 4-[2-[(4-carbamimidoylanilino)-oxomethyl]-4-phenylmethoxyphenyl]benzene-1,3-dicarboxylic acid O1-(2-methoxyethoxymethyl) ester O3-methyl ester IUPAC Name: 1-O-(2-methoxyethoxymethyl) 3-O-methyl 4-[2-[(4-carbamimidoylphenyl)carbamoyl]-4-phenylmethoxyphenyl]benzene-1,3-dicarboxylate Traditional Name: 4-[2-[(4-amidinophenyl)carbamoyl]-4-benzoxy-phenyl]benzene-1,3-dicarboxylic acid O1-(2-methoxyethoxymethyl) ester O3-methyl ester Formula: C34H33N3O8 MolecularWeight: 611.64112

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Descriptors Computed from Structure

Canonical SMILES:

COCCOCOC(=O)C1=CC(=C(C=C1)C2=C(C=C(C=C2)OCC3=CC=CC=C3)C(=O)NC4=CC=C(C=C4)C(=N)N)C(=O)OC

Isomeric SMILES

COCCOCOC(=O)C1=CC(=C(C=C1)C2=C(C=C(C=C2)OCC3=CC=CC=C3)C(=O)NC4=CC=C(C=C4)C(=N)N)C(=O)OC

InChI

InChI=1S/C34H33N3O8/c1-41-16-17-43-21-45-33(39)24-10-14-28(30(18-24)34(40)42-2)27-15-13-26(44-20-22-6-4-3-5-7-22)19-29(27)32(38)37-25-11-8-23(9-12-25)31(35)36/h3-15,18-19H,16-17,20-21H2,1-2H3,(H3,35,36)(H,37,38)