(1E,4Z,6E)-5-azanyl-1,7-bis(3-methoxy-4-oxidanyl-phenyl)hepta-1,4,6-trien-3-one

Systemtic Name: (1E,4Z,6E)-5-azanyl-1,7-bis(3-methoxy-4-oxidanyl-phenyl)hepta-1,4,6-trien-3-one Openeye Name: (1E,4Z,6E)-5-amino-1,7-bis(4-hydroxy-3-methoxy-phenyl)hepta-1,4,6-trien-3-one CAS Name: (1E,4Z,6E)-5-amino-1,7-bis(4-hydroxy-3-methoxyphenyl)-3-hepta-1,4,6-trienone IUPAC Name: (1E,4Z,6E)-5-amino-1,7-bis(4-hydroxy-3-methoxyphenyl)hepta-1,4,6-trien-3-one Traditional Name: (1E,4Z,6E)-5-amino-1,7-bis(4-hydroxy-3-methoxy-phenyl)hepta-1,4,6-trien-3-one Formula: C21H21NO5 MolecularWeight: 367.39514

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=CC(=C1)C=CC(=CC(=O)C=CC2=CC(=C(C=C2)O)OC)N)O

Isomeric SMILES

COC1=C(C=CC(=C1)/C=C/C(=C/C(=O)/C=C/C2=CC(=C(C=C2)O)OC)/N)O

InChI

InChI=1S/C21H21NO5/c1-26-20-11-14(5-9-18(20)24)3-7-16(22)13-17(23)8-4-15-6-10-19(25)21(12-15)27-2/h3-13,24-25H,22H2,1-2H3/b7-3+,8-4+,16-13-