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

Systemtic Name: cyclohexyl 2-[1-[[1-(4-carbamimidoylphenyl)piperidin-4-yl]methyl]piperidin-4-yl]ethanoate Openeye Name: cyclohexyl 2-[1-[[1-(4-carbamimidoylphenyl)-4-piperidyl]methyl]-4-piperidyl]acetate CAS Name: 2-[1-[[1-(4-carbamimidoylphenyl)-4-piperidinyl]methyl]-4-piperidinyl]acetic acid cyclohexyl ester IUPAC Name: cyclohexyl 2-[1-[[1-(4-carbamimidoylphenyl)piperidin-4-yl]methyl]piperidin-4-yl]acetate Traditional Name: 2-[1-[[1-(4-amidinophenyl)-4-piperidyl]methyl]-4-piperidyl]acetic acid cyclohexyl ester Formula: C26H40N4O2 MolecularWeight: 440.6214

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC(CC1)OC(=O)CC2CCN(CC2)CC3CCN(CC3)C4=CC=C(C=C4)C(=N)N

Isomeric SMILES

C1CCC(CC1)OC(=O)CC2CCN(CC2)CC3CCN(CC3)C4=CC=C(C=C4)C(=N)N

InChI

InChI=1S/C26H40N4O2/c27-26(28)22-6-8-23(9-7-22)30-16-12-21(13-17-30)19-29-14-10-20(11-15-29)18-25(31)32-24-4-2-1-3-5-24/h6-9,20-21,24H,1-5,10-19H2,(H3,27,28)