6-[(E)-3-(4-piperidin-1-ylphenyl)prop-2-enoyl]-4H-1,4-benzoxazin-3-one

Systemtic Name: 6-[(E)-3-(4-piperidin-1-ylphenyl)prop-2-enoyl]-4H-1,4-benzoxazin-3-one Openeye Name: 6-[(E)-3-[4-(1-piperidyl)phenyl]prop-2-enoyl]-4H-1,4-benzoxazin-3-one CAS Name: 6-[(E)-1-oxo-3-[4-(1-piperidinyl)phenyl]prop-2-enyl]-4H-1,4-benzoxazin-3-one IUPAC Name: 6-[(E)-3-(4-piperidin-1-ylphenyl)prop-2-enoyl]-4H-1,4-benzoxazin-3-one Traditional Name: 6-[(E)-3-(4-piperidinophenyl)acryloyl]-4H-1,4-benzoxazin-3-one Formula: C22H22N2O3 MolecularWeight: 362.42168

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Descriptors Computed from Structure

Canonical SMILES:

C1CCN(CC1)C2=CC=C(C=C2)C=CC(=O)C3=CC4=C(C=C3)OCC(=O)N4

Isomeric SMILES

C1CCN(CC1)C2=CC=C(C=C2)/C=C/C(=O)C3=CC4=C(C=C3)OCC(=O)N4

InChI

InChI=1S/C22H22N2O3/c25-20(17-7-11-21-19(14-17)23-22(26)15-27-21)10-6-16-4-8-18(9-5-16)24-12-2-1-3-13-24/h4-11,14H,1-3,12-13,15H2,(H,23,26)/b10-6+