3-[4-[5-[di(propan-2-yl)amino]pentyl]-3-oxidanylidene-1,4-benzoxazin-2-yl]benzenecarbonitrile

Systemtic Name: 3-[4-[5-[di(propan-2-yl)amino]pentyl]-3-oxidanylidene-1,4-benzoxazin-2-yl]benzenecarbonitrile Openeye Name: 3-[4-[5-(diisopropylamino)pentyl]-3-oxo-1,4-benzoxazin-2-yl]benzonitrile CAS Name: 3-[4-[5-[di(propan-2-yl)amino]pentyl]-3-oxo-1,4-benzoxazin-2-yl]benzonitrile IUPAC Name: 3-[4-[5-[di(propan-2-yl)amino]pentyl]-3-oxo-1,4-benzoxazin-2-yl]benzonitrile Traditional Name: 3-[4-[5-(diisopropylamino)pentyl]-3-keto-1,4-benzoxazin-2-yl]benzonitrile Formula: C26H33N3O2 MolecularWeight: 419.55912

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)N(CCCCCN1C2=CC=CC=C2OC(C1=O)C3=CC=CC(=C3)C#N)C(C)C

Isomeric SMILES

CC(C)N(CCCCCN1C2=CC=CC=C2OC(C1=O)C3=CC=CC(=C3)C#N)C(C)C

InChI

InChI=1S/C26H33N3O2/c1-19(2)28(20(3)4)15-8-5-9-16-29-23-13-6-7-14-24(23)31-25(26(29)30)22-12-10-11-21(17-22)18-27/h6-7,10-14,17,19-20,25H,5,8-9,15-16H2,1-4H3