methyl 3-[4-[5-(4-carbamimidoylphenyl)oxolan-2-yl]phenyl]propanoate

Systemtic Name: methyl 3-[4-[5-(4-carbamimidoylphenyl)oxolan-2-yl]phenyl]propanoate Openeye Name: methyl 3-[4-[5-(4-carbamimidoylphenyl)tetrahydrofuran-2-yl]phenyl]propanoate CAS Name: 3-[4-[5-(4-carbamimidoylphenyl)-2-oxolanyl]phenyl]propanoic acid methyl ester IUPAC Name: methyl 3-[4-[5-(4-carbamimidoylphenyl)oxolan-2-yl]phenyl]propanoate Traditional Name: 3-[4-[5-(4-amidinophenyl)tetrahydrofuran-2-yl]phenyl]propionic acid methyl ester Formula: C21H24N2O3 MolecularWeight: 352.42686

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)CCC1=CC=C(C=C1)C2CCC(O2)C3=CC=C(C=C3)C(=N)N

Isomeric SMILES

COC(=O)CCC1=CC=C(C=C1)C2CCC(O2)C3=CC=C(C=C3)C(=N)N

InChI

InChI=1S/C21H24N2O3/c1-25-20(24)13-4-14-2-5-15(6-3-14)18-11-12-19(26-18)16-7-9-17(10-8-16)21(22)23/h2-3,5-10,18-19H,4,11-13H2,1H3,(H3,22,23)