4-(3-carbamimidoylphenoxy)-1-ethyl-N-[(4-methoxyphenyl)methyl]pyrrolidine-2-carboxamide

Systemtic Name: 4-(3-carbamimidoylphenoxy)-1-ethyl-N-[(4-methoxyphenyl)methyl]pyrrolidine-2-carboxamide Openeye Name: 4-(3-carbamimidoylphenoxy)-1-ethyl-N-[(4-methoxyphenyl)methyl]pyrrolidine-2-carboxamide CAS Name: 4-(3-carbamimidoylphenoxy)-1-ethyl-N-[(4-methoxyphenyl)methyl]-2-pyrrolidinecarboxamide IUPAC Name: 4-(3-carbamimidoylphenoxy)-1-ethyl-N-[(4-methoxyphenyl)methyl]pyrrolidine-2-carboxamide Traditional Name: 4-(3-amidinophenoxy)-1-ethyl-N-p-anisyl-pyrrolidine-2-carboxamide Formula: C22H28N4O3 MolecularWeight: 396.48272

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCN1CC(CC1C(=O)NCC2=CC=C(C=C2)OC)OC3=CC=CC(=C3)C(=N)N

Isomeric SMILES

CCN1CC(CC1C(=O)NCC2=CC=C(C=C2)OC)OC3=CC=CC(=C3)C(=N)N

InChI

InChI=1S/C22H28N4O3/c1-3-26-14-19(29-18-6-4-5-16(11-18)21(23)24)12-20(26)22(27)25-13-15-7-9-17(28-2)10-8-15/h4-11,19-20H,3,12-14H2,1-2H3,(H3,23,24)(H,25,27)