N-[[4-[(N'-cyanocarbamimidoyl)-methoxy-amino]-1-phenyl-cyclohexyl]methyl]-2-methoxy-benzamide

Systemtic Name: N-[[4-[(N'-cyanocarbamimidoyl)-methoxy-amino]-1-phenyl-cyclohexyl]methyl]-2-methoxy-benzamide Openeye Name: N-[[4-[(N'-cyanocarbamimidoyl)-methoxy-amino]-1-phenyl-cyclohexyl]methyl]-2-methoxy-benzamide CAS Name: N-[[4-[[amino(cyanoimino)methyl]-methoxyamino]-1-phenylcyclohexyl]methyl]-2-methoxybenzamide IUPAC Name: N-[[4-[(N'-cyanocarbamimidoyl)-methoxyamino]-1-phenylcyclohexyl]methyl]-2-methoxybenzamide Traditional Name: N-[[4-[(N'-cyanoamidino)-methoxy-amino]-1-phenyl-cyclohexyl]methyl]-2-methoxy-benzamide Formula: C24H29N5O3 MolecularWeight: 435.51876

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=CC=C1C(=O)NCC2(CCC(CC2)N(C(=NC#N)N)OC)C3=CC=CC=C3

Isomeric SMILES

COC1=CC=CC=C1C(=O)NCC2(CCC(CC2)N(C(=NC#N)N)OC)C3=CC=CC=C3

InChI

InChI=1S/C24H29N5O3/c1-31-21-11-7-6-10-20(21)22(30)27-16-24(18-8-4-3-5-9-18)14-12-19(13-15-24)29(32-2)23(26)28-17-25/h3-11,19H,12-16H2,1-2H3,(H2,26,28)(H,27,30)