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

Systemtic Name: methyl 3-carbamimidoyl-4-[2-[4-(3-cyclohexyloxy-3-oxidanylidene-propyl)phenyl]-1-methyl-imidazol-4-yl]benzoate Openeye Name: methyl 3-carbamimidoyl-4-[2-[4-[3-(cyclohexoxy)-3-oxo-propyl]phenyl]-1-methyl-imidazol-4-yl]benzoate CAS Name: 3-carbamimidoyl-4-[2-[4-(3-cyclohexyloxy-3-oxopropyl)phenyl]-1-methyl-4-imidazolyl]benzoic acid methyl ester IUPAC Name: methyl 3-carbamimidoyl-4-[2-[4-(3-cyclohexyloxy-3-oxopropyl)phenyl]-1-methylimidazol-4-yl]benzoate Traditional Name: 3-amidino-4-[2-[4-[3-(cyclohexoxy)-3-keto-propyl]phenyl]-1-methyl-imidazol-4-yl]benzoic acid methyl ester Formula: C28H32N4O4 MolecularWeight: 488.57808

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Descriptors Computed from Structure

Canonical SMILES:

CN1C=C(N=C1C2=CC=C(C=C2)CCC(=O)OC3CCCCC3)C4=C(C=C(C=C4)C(=O)OC)C(=N)N

Isomeric SMILES

CN1C=C(N=C1C2=CC=C(C=C2)CCC(=O)OC3CCCCC3)C4=C(C=C(C=C4)C(=O)OC)C(=N)N

InChI

InChI=1S/C28H32N4O4/c1-32-17-24(22-14-13-20(28(34)35-2)16-23(22)26(29)30)31-27(32)19-11-8-18(9-12-19)10-15-25(33)36-21-6-4-3-5-7-21/h8-9,11-14,16-17,21H,3-7,10,15H2,1-2H3,(H3,29,30)