2-[[5-carbamimidoyl-2-(hydroxymethyl)phenyl]amino]-2-(4-piperidin-4-yloxyphenyl)ethanamide dihydrochloride

Systemtic Name: 2-[[5-carbamimidoyl-2-(hydroxymethyl)phenyl]amino]-2-(4-piperidin-4-yloxyphenyl)ethanamide dihydrochloride Openeye Name: 2-[5-carbamimidoyl-2-(hydroxymethyl)anilino]-2-[4-(4-piperidyloxy)phenyl]acetamide dihydrochloride CAS Name: 2-[5-carbamimidoyl-2-(hydroxymethyl)anilino]-2-[4-(4-piperidinyloxy)phenyl]acetamide dihydrochloride IUPAC Name: 2-[5-carbamimidoyl-2-(hydroxymethyl)anilino]-2-(4-piperidin-4-yloxyphenyl)acetamide dihydrochloride Traditional Name: 2-(5-amidino-2-methylol-anilino)-2-[4-(4-piperidyloxy)phenyl]acetamide dihydrochloride Formula: C21H29Cl2N5O3 MolecularWeight: 470.39266

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Descriptors Computed from Structure

Canonical SMILES:

C1CNCCC1OC2=CC=C(C=C2)C(C(=O)N)NC3=C(C=CC(=C3)C(=N)N)CO.Cl.Cl

Isomeric SMILES

C1CNCCC1OC2=CC=C(C=C2)C(C(=O)N)NC3=C(C=CC(=C3)C(=N)N)CO.Cl.Cl

InChI

InChI=1S/C21H27N5O3.2ClH/c22-20(23)14-1-2-15(12-27)18(11-14)26-19(21(24)28)13-3-5-16(6-4-13)29-17-7-9-25-10-8-17;;/h1-6,11,17,19,25-27H,7-10,12H2,(H3,22,23)(H2,24,28);2*1H