3-[2,3-bis(oxidanyl)propyl]-2-(4-carbamimidoylphenyl)-1H-indole-6-carboximidamide

Systemtic Name: 3-[2,3-bis(oxidanyl)propyl]-2-(4-carbamimidoylphenyl)-1H-indole-6-carboximidamide Openeye Name: 2-(4-carbamimidoylphenyl)-3-(2,3-dihydroxypropyl)-1H-indole-6-carboxamidine CAS Name: 2-(4-carbamimidoylphenyl)-3-(2,3-dihydroxypropyl)-1H-indole-6-carboximidamide IUPAC Name: 2-(4-carbamimidoylphenyl)-3-(2,3-dihydroxypropyl)-1H-indole-6-carboximidamide Traditional Name: 2-(4-amidinophenyl)-3-glyceryl-1H-indole-6-carboxamidine Formula: C19H21N5O2 MolecularWeight: 351.40234

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC=C1C2=C(C3=C(N2)C=C(C=C3)C(=N)N)CC(CO)O)C(=N)N

Isomeric SMILES

C1=CC(=CC=C1C2=C(C3=C(N2)C=C(C=C3)C(=N)N)CC(CO)O)C(=N)N

InChI

InChI=1S/C19H21N5O2/c20-18(21)11-3-1-10(2-4-11)17-15(8-13(26)9-25)14-6-5-12(19(22)23)7-16(14)24-17/h1-7,13,24-26H,8-9H2,(H3,20,21)(H3,22,23)