(6Z)-4-[(5-bromanyl-3-ethoxy-2-oxidanyl-phenyl)methylamino]-6-(6-methyl-3H-1,3-benzoxazol-2-ylidene)cyclohexa-2,4-dien-1-one

Systemtic Name: (6Z)-4-[(5-bromanyl-3-ethoxy-2-oxidanyl-phenyl)methylamino]-6-(6-methyl-3H-1,3-benzoxazol-2-ylidene)cyclohexa-2,4-dien-1-one Openeye Name: (6Z)-4-[(5-bromo-3-ethoxy-2-hydroxy-phenyl)methylamino]-6-(6-methyl-3H-1,3-benzoxazol-2-ylidene)cyclohexa-2,4-dien-1-one CAS Name: (6Z)-4-[(5-bromo-3-ethoxy-2-hydroxyphenyl)methylamino]-6-(6-methyl-3H-1,3-benzoxazol-2-ylidene)-1-cyclohexa-2,4-dienone IUPAC Name: (6Z)-4-[(5-bromo-3-ethoxy-2-hydroxyphenyl)methylamino]-6-(6-methyl-3H-1,3-benzoxazol-2-ylidene)cyclohexa-2,4-dien-1-one Traditional Name: (6Z)-4-[(5-bromo-3-ethoxy-2-hydroxy-benzyl)amino]-6-(6-methyl-3H-1,3-benzoxazol-2-ylidene)cyclohexa-2,4-dien-1-one Formula: C23H21BrN2O4 MolecularWeight: 469.32784

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=C(C(=CC(=C1)Br)CNC2=CC(=C3NC4=C(O3)C=C(C=C4)C)C(=O)C=C2)O

Isomeric SMILES

CCOC1=C(C(=CC(=C1)Br)CNC2=C/C(=C/3\NC4=C(O3)C=C(C=C4)C)/C(=O)C=C2)O

InChI

InChI=1S/C23H21BrN2O4/c1-3-29-21-10-15(24)9-14(22(21)28)12-25-16-5-7-19(27)17(11-16)23-26-18-6-4-13(2)8-20(18)30-23/h4-11,25-26,28H,3,12H2,1-2H3/b23-17-