methyl 3-carbamimidoyl-4-[1-methyl-2-[4-(3-oxidanylidene-3-phenethyloxy-propyl)phenyl]imidazol-4-yl]benzoate

Systemtic Name: methyl 3-carbamimidoyl-4-[1-methyl-2-[4-(3-oxidanylidene-3-phenethyloxy-propyl)phenyl]imidazol-4-yl]benzoate Openeye Name: methyl 3-carbamimidoyl-4-[1-methyl-2-[4-(3-oxo-3-phenethyloxy-propyl)phenyl]imidazol-4-yl]benzoate CAS Name: 3-carbamimidoyl-4-[1-methyl-2-[4-(3-oxo-3-phenethyloxypropyl)phenyl]-4-imidazolyl]benzoic acid methyl ester IUPAC Name: methyl 3-carbamimidoyl-4-[1-methyl-2-[4-(3-oxo-3-phenethyloxypropyl)phenyl]imidazol-4-yl]benzoate Traditional Name: 3-amidino-4-[2-[4-(3-keto-3-phenethyloxy-propyl)phenyl]-1-methyl-imidazol-4-yl]benzoic acid methyl ester Formula: C30H30N4O4 MolecularWeight: 510.5836

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Descriptors Computed from Structure

Canonical SMILES:

CN1C=C(N=C1C2=CC=C(C=C2)CCC(=O)OCCC3=CC=CC=C3)C4=C(C=C(C=C4)C(=O)OC)C(=N)N

Isomeric SMILES

CN1C=C(N=C1C2=CC=C(C=C2)CCC(=O)OCCC3=CC=CC=C3)C4=C(C=C(C=C4)C(=O)OC)C(=N)N

InChI

InChI=1S/C30H30N4O4/c1-34-19-26(24-14-13-23(30(36)37-2)18-25(24)28(31)32)33-29(34)22-11-8-21(9-12-22)10-15-27(35)38-17-16-20-6-4-3-5-7-20/h3-9,11-14,18-19H,10,15-17H2,1-2H3,(H3,31,32)