4-[2-[1-(azepan-2-yl)ethyl]-1,3-benzoxazol-5-yl]benzenecarbonitrile

Systemtic Name: 4-[2-[1-(azepan-2-yl)ethyl]-1,3-benzoxazol-5-yl]benzenecarbonitrile Openeye Name: 4-[2-[1-(azepan-2-yl)ethyl]-1,3-benzoxazol-5-yl]benzonitrile CAS Name: 4-[2-[1-(2-azepanyl)ethyl]-1,3-benzoxazol-5-yl]benzonitrile IUPAC Name: 4-[2-[1-(azepan-2-yl)ethyl]-1,3-benzoxazol-5-yl]benzonitrile Traditional Name: 4-[2-[1-(azepan-2-yl)ethyl]-1,3-benzoxazol-5-yl]benzonitrile Formula: C22H23N3O MolecularWeight: 345.43752

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Descriptors Computed from Structure

Canonical SMILES:

CC(C1CCCCCN1)C2=NC3=C(O2)C=CC(=C3)C4=CC=C(C=C4)C#N

Isomeric SMILES

CC(C1CCCCCN1)C2=NC3=C(O2)C=CC(=C3)C4=CC=C(C=C4)C#N

InChI

InChI=1S/C22H23N3O/c1-15(19-5-3-2-4-12-24-19)22-25-20-13-18(10-11-21(20)26-22)17-8-6-16(14-23)7-9-17/h6-11,13,15,19,24H,2-5,12H2,1H3