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

Systemtic Name: 2-[[5-carbamimidoyl-2-(hydroxymethyl)phenyl]amino]-2-(4-piperidin-4-yloxyphenyl)ethanamide Openeye Name: 2-[5-carbamimidoyl-2-(hydroxymethyl)anilino]-2-[4-(4-piperidyloxy)phenyl]acetamide CAS Name: 2-[5-carbamimidoyl-2-(hydroxymethyl)anilino]-2-[4-(4-piperidinyloxy)phenyl]acetamide IUPAC Name: 2-[5-carbamimidoyl-2-(hydroxymethyl)anilino]-2-(4-piperidin-4-yloxyphenyl)acetamide Traditional Name: 2-(5-amidino-2-methylol-anilino)-2-[4-(4-piperidyloxy)phenyl]acetamide Formula: C21H27N5O3 MolecularWeight: 397.47078

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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

Isomeric SMILES

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

InChI

InChI=1S/C21H27N5O3/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)