(6E)-4-methoxy-6-[4-[(pyridin-2-ylmethylamino)methyl]-3H-1,3-benzoxazol-2-ylidene]cyclohexa-2,4-dien-1-one

Systemtic Name: (6E)-4-methoxy-6-[4-[(pyridin-2-ylmethylamino)methyl]-3H-1,3-benzoxazol-2-ylidene]cyclohexa-2,4-dien-1-one Openeye Name: (6E)-4-methoxy-6-[4-[(2-pyridylmethylamino)methyl]-3H-1,3-benzoxazol-2-ylidene]cyclohexa-2,4-dien-1-one CAS Name: (6E)-4-methoxy-6-[4-[(2-pyridinylmethylamino)methyl]-3H-1,3-benzoxazol-2-ylidene]-1-cyclohexa-2,4-dienone IUPAC Name: (6E)-4-methoxy-6-[4-[(pyridin-2-ylmethylamino)methyl]-3H-1,3-benzoxazol-2-ylidene]cyclohexa-2,4-dien-1-one Traditional Name: (6E)-4-methoxy-6-[4-[(2-pyridylmethylamino)methyl]-3H-1,3-benzoxazol-2-ylidene]cyclohexa-2,4-dien-1-one Formula: C21H19N3O3 MolecularWeight: 361.39386

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC(=C2NC3=C(C=CC=C3O2)CNCC4=CC=CC=N4)C(=O)C=C1

Isomeric SMILES

COC1=C/C(=C\2/NC3=C(C=CC=C3O2)CNCC4=CC=CC=N4)/C(=O)C=C1

InChI

InChI=1S/C21H19N3O3/c1-26-16-8-9-18(25)17(11-16)21-24-20-14(5-4-7-19(20)27-21)12-22-13-15-6-2-3-10-23-15/h2-11,22,24H,12-13H2,1H3/b21-17+