methyl 2-[1-[[4-(4-carbamimidoylphenyl)phenyl]methyl]piperidin-4-yl]ethanoate

Systemtic Name: methyl 2-[1-[[4-(4-carbamimidoylphenyl)phenyl]methyl]piperidin-4-yl]ethanoate Openeye Name: methyl 2-[1-[[4-(4-carbamimidoylphenyl)phenyl]methyl]-4-piperidyl]acetate CAS Name: 2-[1-[[4-(4-carbamimidoylphenyl)phenyl]methyl]-4-piperidinyl]acetic acid methyl ester IUPAC Name: methyl 2-[1-[[4-(4-carbamimidoylphenyl)phenyl]methyl]piperidin-4-yl]acetate Traditional Name: 2-[1-[4-(4-amidinophenyl)benzyl]-4-piperidyl]acetic acid methyl ester Formula: C22H27N3O2 MolecularWeight: 365.46868

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)CC1CCN(CC1)CC2=CC=C(C=C2)C3=CC=C(C=C3)C(=N)N

Isomeric SMILES

COC(=O)CC1CCN(CC1)CC2=CC=C(C=C2)C3=CC=C(C=C3)C(=N)N

InChI

InChI=1S/C22H27N3O2/c1-27-21(26)14-16-10-12-25(13-11-16)15-17-2-4-18(5-3-17)19-6-8-20(9-7-19)22(23)24/h2-9,16H,10-15H2,1H3,(H3,23,24)