5-bromanyl-N-(N'-cyclooctylcarbamimidoyl)-2-prop-2-ynoxy-benzamide hydrochloride

Systemtic Name: 5-bromanyl-N-(N'-cyclooctylcarbamimidoyl)-2-prop-2-ynoxy-benzamide hydrochloride Openeye Name: 5-bromo-N-(N'-cyclooctylcarbamimidoyl)-2-prop-2-ynoxy-benzamide hydrochloride CAS Name: N-[amino(cyclooctylimino)methyl]-5-bromo-2-prop-2-ynoxybenzamide hydrochloride IUPAC Name: 5-bromo-N-(N'-cyclooctylcarbamimidoyl)-2-prop-2-ynoxybenzamide hydrochloride Traditional Name: 5-bromo-N-(N'-cyclooctylamidino)-2-propargyloxy-benzamide hydrochloride Formula: C19H25BrClN3O2 MolecularWeight: 442.7777

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Descriptors Computed from Structure

Canonical SMILES:

C#CCOC1=C(C=C(C=C1)Br)C(=O)NC(=NC2CCCCCCC2)N.Cl

Isomeric SMILES

C#CCOC1=C(C=C(C=C1)Br)C(=O)NC(=NC2CCCCCCC2)N.Cl

InChI

InChI=1S/C19H24BrN3O2.ClH/c1-2-12-25-17-11-10-14(20)13-16(17)18(24)23-19(21)22-15-8-6-4-3-5-7-9-15;/h1,10-11,13,15H,3-9,12H2,(H3,21,22,23,24);1H