3-[3-oxidanylidene-6-[(6E)-6-(6-oxidanylidenecyclohexa-2,4-dien-1-ylidene)-4-phenyl-1H-pyridin-2-yl]-1,4-benzoxazin-4-yl]propanenitrile

Systemtic Name: 3-[3-oxidanylidene-6-[(6E)-6-(6-oxidanylidenecyclohexa-2,4-dien-1-ylidene)-4-phenyl-1H-pyridin-2-yl]-1,4-benzoxazin-4-yl]propanenitrile Openeye Name: 3-[3-oxo-6-[(6E)-6-(6-oxocyclohexa-2,4-dien-1-ylidene)-4-phenyl-1H-pyridin-2-yl]-1,4-benzoxazin-4-yl]propanenitrile CAS Name: 3-[3-oxo-6-[(6E)-6-(6-oxo-1-cyclohexa-2,4-dienylidene)-4-phenyl-1H-pyridin-2-yl]-1,4-benzoxazin-4-yl]propanenitrile IUPAC Name: 3-[3-oxo-6-[(6E)-6-(6-oxocyclohexa-2,4-dien-1-ylidene)-4-phenyl-1H-pyridin-2-yl]-1,4-benzoxazin-4-yl]propanenitrile Traditional Name: 3-[3-keto-6-[(6E)-6-(6-ketocyclohexa-2,4-dien-1-ylidene)-4-phenyl-1H-pyridin-2-yl]-1,4-benzoxazin-4-yl]propionitrile Formula: C28H21N3O3 MolecularWeight: 447.48464

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Descriptors Computed from Structure

Canonical SMILES:

C1C(=O)N(C2=C(O1)C=CC(=C2)C3=CC(=CC(=C4C=CC=CC4=O)N3)C5=CC=CC=C5)CCC#N

Isomeric SMILES

C1C(=O)N(C2=C(O1)C=CC(=C2)C3=CC(=C/C(=C\4/C=CC=CC4=O)/N3)C5=CC=CC=C5)CCC#N

InChI

InChI=1S/C28H21N3O3/c29-13-6-14-31-25-17-20(11-12-27(25)34-18-28(31)33)23-15-21(19-7-2-1-3-8-19)16-24(30-23)22-9-4-5-10-26(22)32/h1-5,7-12,15-17,30H,6,14,18H2/b24-22+