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

Systemtic Name: 3,4-dimethoxy-6-[4-[(pyridin-2-ylmethylamino)methyl]-3H-1,3-benzoxazol-2-ylidene]cyclohexa-2,4-dien-1-one Openeye Name: 3,4-dimethoxy-6-[4-[(2-pyridylmethylamino)methyl]-3H-1,3-benzoxazol-2-ylidene]cyclohexa-2,4-dien-1-one CAS Name: 3,4-dimethoxy-6-[4-[(2-pyridinylmethylamino)methyl]-3H-1,3-benzoxazol-2-ylidene]-1-cyclohexa-2,4-dienone IUPAC Name: 3,4-dimethoxy-6-[4-[(pyridin-2-ylmethylamino)methyl]-3H-1,3-benzoxazol-2-ylidene]cyclohexa-2,4-dien-1-one Traditional Name: 3,4-dimethoxy-6-[4-[(2-pyridylmethylamino)methyl]-3H-1,3-benzoxazol-2-ylidene]cyclohexa-2,4-dien-1-one Formula: C22H21N3O4 MolecularWeight: 391.41984

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC(=C2NC3=C(C=CC=C3O2)CNCC4=CC=CC=N4)C(=O)C=C1OC

Isomeric SMILES

COC1=CC(=C2NC3=C(C=CC=C3O2)CNCC4=CC=CC=N4)C(=O)C=C1OC

InChI

InChI=1S/C22H21N3O4/c1-27-19-10-16(17(26)11-20(19)28-2)22-25-21-14(6-5-8-18(21)29-22)12-23-13-15-7-3-4-9-24-15/h3-11,23,25H,12-13H2,1-2H3