1-[2-(6-chloranyl-1,2-benzoxazol-3-yl)phenyl]but-3-yn-1-amine

Systemtic Name: 1-[2-(6-chloranyl-1,2-benzoxazol-3-yl)phenyl]but-3-yn-1-amine Openeye Name: 1-[2-(6-chloro-1,2-benzoxazol-3-yl)phenyl]but-3-yn-1-amine CAS Name: 1-[2-(6-chloro-1,2-benzoxazol-3-yl)phenyl]-3-butyn-1-amine IUPAC Name: 1-[2-(6-chloro-1,2-benzoxazol-3-yl)phenyl]but-3-yn-1-amine Traditional Name: 1-[2-(6-chloroindoxazen-3-yl)phenyl]but-3-ynylamine Formula: C17H13ClN2O MolecularWeight: 296.75092

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Descriptors Computed from Structure

Canonical SMILES:

C#CCC(C1=CC=CC=C1C2=NOC3=C2C=CC(=C3)Cl)N

Isomeric SMILES

C#CCC(C1=CC=CC=C1C2=NOC3=C2C=CC(=C3)Cl)N

InChI

InChI=1S/C17H13ClN2O/c1-2-5-15(19)12-6-3-4-7-13(12)17-14-9-8-11(18)10-16(14)21-20-17/h1,3-4,6-10,15H,5,19H2