N-[[4-carbamimidoyl-2-(pyridin-2-ylmethoxy)phenyl]methyl]-3-methyl-benzamide hydrochloride

Systemtic Name: N-[[4-carbamimidoyl-2-(pyridin-2-ylmethoxy)phenyl]methyl]-3-methyl-benzamide hydrochloride Openeye Name: N-[[4-carbamimidoyl-2-(2-pyridylmethoxy)phenyl]methyl]-3-methyl-benzamide hydrochloride CAS Name: N-[[4-carbamimidoyl-2-(2-pyridinylmethoxy)phenyl]methyl]-3-methylbenzamide hydrochloride IUPAC Name: N-[[4-carbamimidoyl-2-(pyridin-2-ylmethoxy)phenyl]methyl]-3-methylbenzamide hydrochloride Traditional Name: N-[4-amidino-2-(2-pyridylmethoxy)benzyl]-3-methyl-benzamide hydrochloride Formula: C22H23ClN4O2 MolecularWeight: 410.89662

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC(=C1)C(=O)NCC2=C(C=C(C=C2)C(=N)N)OCC3=CC=CC=N3.Cl

Isomeric SMILES

CC1=CC=CC(=C1)C(=O)NCC2=C(C=C(C=C2)C(=N)N)OCC3=CC=CC=N3.Cl

InChI

InChI=1S/C22H22N4O2.ClH/c1-15-5-4-6-17(11-15)22(27)26-13-18-9-8-16(21(23)24)12-20(18)28-14-19-7-2-3-10-25-19;/h2-12H,13-14H2,1H3,(H3,23,24)(H,26,27);1H