4-[2-[2-[butyl(methyl)amino]ethyl]-1,3-benzoxazol-5-yl]benzenecarbonitrile

Systemtic Name: 4-[2-[2-[butyl(methyl)amino]ethyl]-1,3-benzoxazol-5-yl]benzenecarbonitrile Openeye Name: 4-[2-[2-[butyl(methyl)amino]ethyl]-1,3-benzoxazol-5-yl]benzonitrile CAS Name: 4-[2-[2-[butyl(methyl)amino]ethyl]-1,3-benzoxazol-5-yl]benzonitrile IUPAC Name: 4-[2-[2-[butyl(methyl)amino]ethyl]-1,3-benzoxazol-5-yl]benzonitrile Traditional Name: 4-[2-[2-[butyl(methyl)amino]ethyl]-1,3-benzoxazol-5-yl]benzonitrile Formula: C21H23N3O MolecularWeight: 333.42682

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Descriptors Computed from Structure

Canonical SMILES:

CCCCN(C)CCC1=NC2=C(O1)C=CC(=C2)C3=CC=C(C=C3)C#N

Isomeric SMILES

CCCCN(C)CCC1=NC2=C(O1)C=CC(=C2)C3=CC=C(C=C3)C#N

InChI

InChI=1S/C21H23N3O/c1-3-4-12-24(2)13-11-21-23-19-14-18(9-10-20(19)25-21)17-7-5-16(15-22)6-8-17/h5-10,14H,3-4,11-13H2,1-2H3