methyl 5-[[1-(4-carbamimidoylphenyl)piperidin-4-yl]amino]-5-oxidanylidene-pentanoate

Systemtic Name: methyl 5-[[1-(4-carbamimidoylphenyl)piperidin-4-yl]amino]-5-oxidanylidene-pentanoate Openeye Name: methyl 5-[[1-(4-carbamimidoylphenyl)-4-piperidyl]amino]-5-oxo-pentanoate CAS Name: 5-[[1-(4-carbamimidoylphenyl)-4-piperidinyl]amino]-5-oxopentanoic acid methyl ester IUPAC Name: methyl 5-[[1-(4-carbamimidoylphenyl)piperidin-4-yl]amino]-5-oxopentanoate Traditional Name: 5-[[1-(4-amidinophenyl)-4-piperidyl]amino]-5-keto-valeric acid methyl ester Formula: C18H26N4O3 MolecularWeight: 346.42404

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)CCCC(=O)NC1CCN(CC1)C2=CC=C(C=C2)C(=N)N

Isomeric SMILES

COC(=O)CCCC(=O)NC1CCN(CC1)C2=CC=C(C=C2)C(=N)N

InChI

InChI=1S/C18H26N4O3/c1-25-17(24)4-2-3-16(23)21-14-9-11-22(12-10-14)15-7-5-13(6-8-15)18(19)20/h5-8,14H,2-4,9-12H2,1H3,(H3,19,20)(H,21,23)