(Z)-2-(1,2-benzoxazol-3-yl)-3-[3-(3-piperidin-1-ylpropoxy)phenyl]prop-2-enenitrile

Systemtic Name: (Z)-2-(1,2-benzoxazol-3-yl)-3-[3-(3-piperidin-1-ylpropoxy)phenyl]prop-2-enenitrile Openeye Name: (Z)-2-(1,2-benzoxazol-3-yl)-3-[3-[3-(1-piperidyl)propoxy]phenyl]prop-2-enenitrile CAS Name: (Z)-2-(1,2-benzoxazol-3-yl)-3-[3-[3-(1-piperidinyl)propoxy]phenyl]-2-propenenitrile IUPAC Name: (Z)-2-(1,2-benzoxazol-3-yl)-3-[3-(3-piperidin-1-ylpropoxy)phenyl]prop-2-enenitrile Traditional Name: (Z)-2-indoxazen-3-yl-3-[3-(3-piperidinopropoxy)phenyl]acrylonitrile Formula: C24H25N3O2 MolecularWeight: 387.4742

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Descriptors Computed from Structure

Canonical SMILES:

C1CCN(CC1)CCCOC2=CC=CC(=C2)C=C(C#N)C3=NOC4=CC=CC=C43

Isomeric SMILES

C1CCN(CC1)CCCOC2=CC=CC(=C2)/C=C(\C#N)/C3=NOC4=CC=CC=C43

InChI

InChI=1S/C24H25N3O2/c25-18-20(24-22-10-2-3-11-23(22)29-26-24)16-19-8-6-9-21(17-19)28-15-7-14-27-12-4-1-5-13-27/h2-3,6,8-11,16-17H,1,4-5,7,12-15H2/b20-16+