1-[2-(6-fluoranyl-1,2-benzoxazol-3-yl)phenyl]-3-methyl-but-3-en-1-amine hydrochloride

Systemtic Name: 1-[2-(6-fluoranyl-1,2-benzoxazol-3-yl)phenyl]-3-methyl-but-3-en-1-amine hydrochloride Openeye Name: 1-[2-(6-fluoro-1,2-benzoxazol-3-yl)phenyl]-3-methyl-but-3-en-1-amine hydrochloride CAS Name: 1-[2-(6-fluoro-1,2-benzoxazol-3-yl)phenyl]-3-methyl-3-buten-1-amine hydrochloride IUPAC Name: 1-[2-(6-fluoro-1,2-benzoxazol-3-yl)phenyl]-3-methylbut-3-en-1-amine hydrochloride Traditional Name: [1-[2-(6-fluoroindoxazen-3-yl)phenyl]-3-methyl-but-3-enyl]amine hydrochloride Formula: C18H18ClFN2O MolecularWeight: 332.799723

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Descriptors Computed from Structure

Canonical SMILES:

CC(=C)CC(C1=CC=CC=C1C2=NOC3=C2C=CC(=C3)F)N.Cl

Isomeric SMILES

CC(=C)CC(C1=CC=CC=C1C2=NOC3=C2C=CC(=C3)F)N.Cl

InChI

InChI=1S/C18H17FN2O.ClH/c1-11(2)9-16(20)13-5-3-4-6-14(13)18-15-8-7-12(19)10-17(15)22-21-18;/h3-8,10,16H,1,9,20H2,2H3;1H