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

Systemtic Name: methyl 3-carbamimidoyl-4-[2-[4-(3-cyclopentyloxy-3-oxidanylidene-propyl)phenyl]-1-methyl-imidazol-4-yl]benzoate Openeye Name: methyl 3-carbamimidoyl-4-[2-[4-[3-(cyclopentoxy)-3-oxo-propyl]phenyl]-1-methyl-imidazol-4-yl]benzoate CAS Name: 3-carbamimidoyl-4-[2-[4-(3-cyclopentyloxy-3-oxopropyl)phenyl]-1-methyl-4-imidazolyl]benzoic acid methyl ester IUPAC Name: methyl 3-carbamimidoyl-4-[2-[4-(3-cyclopentyloxy-3-oxopropyl)phenyl]-1-methylimidazol-4-yl]benzoate Traditional Name: 3-amidino-4-[2-[4-[3-(cyclopentoxy)-3-keto-propyl]phenyl]-1-methyl-imidazol-4-yl]benzoic acid methyl ester Formula: C27H30N4O4 MolecularWeight: 474.5515

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Descriptors Computed from Structure

Canonical SMILES:

CN1C=C(N=C1C2=CC=C(C=C2)CCC(=O)OC3CCCC3)C4=C(C=C(C=C4)C(=O)OC)C(=N)N

Isomeric SMILES

CN1C=C(N=C1C2=CC=C(C=C2)CCC(=O)OC3CCCC3)C4=C(C=C(C=C4)C(=O)OC)C(=N)N

InChI

InChI=1S/C27H30N4O4/c1-31-16-23(21-13-12-19(27(33)34-2)15-22(21)25(28)29)30-26(31)18-10-7-17(8-11-18)9-14-24(32)35-20-5-3-4-6-20/h7-8,10-13,15-16,20H,3-6,9,14H2,1-2H3,(H3,28,29)