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

Systemtic Name: methyl 2-[1-[[1-(4-carbamimidoylphenyl)piperidin-4-yl]methyl]piperidin-4-ylidene]ethanoate Openeye Name: methyl 2-[1-[[1-(4-carbamimidoylphenyl)-4-piperidyl]methyl]-4-piperidylidene]acetate CAS Name: 2-[1-[[1-(4-carbamimidoylphenyl)-4-piperidinyl]methyl]-4-piperidinylidene]acetic acid methyl ester IUPAC Name: methyl 2-[1-[[1-(4-carbamimidoylphenyl)piperidin-4-yl]methyl]piperidin-4-ylidene]acetate Traditional Name: 2-[1-[[1-(4-amidinophenyl)-4-piperidyl]methyl]-4-piperidylidene]acetic acid methyl ester Formula: C21H30N4O2 MolecularWeight: 370.4885

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C=C1CCN(CC1)CC2CCN(CC2)C3=CC=C(C=C3)C(=N)N

Isomeric SMILES

COC(=O)C=C1CCN(CC1)CC2CCN(CC2)C3=CC=C(C=C3)C(=N)N

InChI

InChI=1S/C21H30N4O2/c1-27-20(26)14-16-6-10-24(11-7-16)15-17-8-12-25(13-9-17)19-4-2-18(3-5-19)21(22)23/h2-5,14,17H,6-13,15H2,1H3,(H3,22,23)