N-[(4-carbamimidoyl-2-methoxy-phenyl)methyl]-1-(2-cyclohexyl-2-oxidanyl-ethanoyl)pyrrolidine-2-carboxamide; ethanoic acid

Systemtic Name: N-[(4-carbamimidoyl-2-methoxy-phenyl)methyl]-1-(2-cyclohexyl-2-oxidanyl-ethanoyl)pyrrolidine-2-carboxamide; ethanoic acid Openeye Name: acetic acid; N-[(4-carbamimidoyl-2-methoxy-phenyl)methyl]-1-(2-cyclohexyl-2-hydroxy-acetyl)pyrrolidine-2-carboxamide CAS Name: acetic acid; N-[(4-carbamimidoyl-2-methoxyphenyl)methyl]-1-(2-cyclohexyl-2-hydroxy-1-oxoethyl)-2-pyrrolidinecarboxamide IUPAC Name: acetic acid; N-[(4-carbamimidoyl-2-methoxyphenyl)methyl]-1-(2-cyclohexyl-2-hydroxyacetyl)pyrrolidine-2-carboxamide Traditional Name: acetic acid; N-(4-amidino-2-methoxy-benzyl)-1-(2-cyclohexyl-2-hydroxy-acetyl)pyrrolidine-2-carboxamide Formula: C24H36N4O6 MolecularWeight: 476.56584

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)O.COC1=C(C=CC(=C1)C(=N)N)CNC(=O)C2CCCN2C(=O)C(C3CCCCC3)O

Isomeric SMILES

CC(=O)O.COC1=C(C=CC(=C1)C(=N)N)CNC(=O)C2CCCN2C(=O)C(C3CCCCC3)O

InChI

InChI=1S/C22H32N4O4.C2H4O2/c1-30-18-12-15(20(23)24)9-10-16(18)13-25-21(28)17-8-5-11-26(17)22(29)19(27)14-6-3-2-4-7-14;1-2(3)4/h9-10,12,14,17,19,27H,2-8,11,13H2,1H3,(H3,23,24)(H,25,28);1H3,(H,3,4)