methyl N-[N-methoxycarbonyl-N'-[3-(4-pyridin-2-ylpiperidin-1-yl)propyl]carbamimidoyl]carbamate

Systemtic Name: methyl N-[N-methoxycarbonyl-N'-[3-(4-pyridin-2-ylpiperidin-1-yl)propyl]carbamimidoyl]carbamate Openeye Name: methyl N-[N-methoxycarbonyl-N'-[3-[4-(2-pyridyl)-1-piperidyl]propyl]carbamimidoyl]carbamate CAS Name: N-[(methoxycarbonylamino)-[3-[4-(2-pyridinyl)-1-piperidinyl]propylimino]methyl]carbamic acid methyl ester IUPAC Name: methyl N-[N-methoxycarbonyl-N'-[3-(4-pyridin-2-ylpiperidin-1-yl)propyl]carbamimidoyl]carbamate Traditional Name: N-[N-carbomethoxy-N'-[3-[4-(2-pyridyl)piperidino]propyl]amidino]carbamic acid methyl ester Formula: C18H27N5O4 MolecularWeight: 377.43808

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)NC(=NCCCN1CCC(CC1)C2=CC=CC=N2)NC(=O)OC

Isomeric SMILES

COC(=O)NC(=NCCCN1CCC(CC1)C2=CC=CC=N2)NC(=O)OC

InChI

InChI=1S/C18H27N5O4/c1-26-17(24)21-16(22-18(25)27-2)20-10-5-11-23-12-7-14(8-13-23)15-6-3-4-9-19-15/h3-4,6,9,14H,5,7-8,10-13H2,1-2H3,(H2,20,21,22,24,25)