(3Z)-7-butoxy-3-[butoxy(oxidanyl)methylidene]isoquinoline-1,4-dione

Systemtic Name: (3Z)-7-butoxy-3-[butoxy(oxidanyl)methylidene]isoquinoline-1,4-dione Openeye Name: (3Z)-7-butoxy-3-[butoxy(hydroxy)methylene]isoquinoline-1,4-dione CAS Name: (3Z)-7-butoxy-3-[butoxy(hydroxy)methylidene]isoquinoline-1,4-dione IUPAC Name: (3Z)-7-butoxy-3-[butoxy(hydroxy)methylidene]isoquinoline-1,4-dione Traditional Name: (3Z)-7-butoxy-3-[butoxy(hydroxy)methylene]isoquinoline-1,4-quinone Formula: C18H23NO5 MolecularWeight: 333.37892

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Descriptors Computed from Structure

Canonical SMILES:

CCCCOC1=CC2=C(C=C1)C(=O)C(=C(O)OCCCC)NC2=O

Isomeric SMILES

CCCCOC1=CC2=C(C=C1)C(=O)/C(=C(\O)/OCCCC)/NC2=O

InChI

InChI=1S/C18H23NO5/c1-3-5-9-23-12-7-8-13-14(11-12)17(21)19-15(16(13)20)18(22)24-10-6-4-2/h7-8,11,22H,3-6,9-10H2,1-2H3,(H,19,21)/b18-15-