4-(3-carbamimidoylphenoxy)-N-(pyridin-3-ylmethyl)pyrrolidine-2-carboxamide

Systemtic Name: 4-(3-carbamimidoylphenoxy)-N-(pyridin-3-ylmethyl)pyrrolidine-2-carboxamide Openeye Name: 4-(3-carbamimidoylphenoxy)-N-(3-pyridylmethyl)pyrrolidine-2-carboxamide CAS Name: 4-(3-carbamimidoylphenoxy)-N-(3-pyridinylmethyl)-2-pyrrolidinecarboxamide IUPAC Name: 4-(3-carbamimidoylphenoxy)-N-(pyridin-3-ylmethyl)pyrrolidine-2-carboxamide Traditional Name: 4-(3-amidinophenoxy)-N-(3-pyridylmethyl)pyrrolidine-2-carboxamide Formula: C18H21N5O2 MolecularWeight: 339.39164

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Descriptors Computed from Structure

Canonical SMILES:

C1C(CNC1C(=O)NCC2=CN=CC=C2)OC3=CC=CC(=C3)C(=N)N

Isomeric SMILES

C1C(CNC1C(=O)NCC2=CN=CC=C2)OC3=CC=CC(=C3)C(=N)N

InChI

InChI=1S/C18H21N5O2/c19-17(20)13-4-1-5-14(7-13)25-15-8-16(22-11-15)18(24)23-10-12-3-2-6-21-9-12/h1-7,9,15-16,22H,8,10-11H2,(H3,19,20)(H,23,24)