4-(butyliminomethyl)-2-(4-ethoxyphenyl)-4H-isoquinoline-1,3-dione

Systemtic Name: 4-(butyliminomethyl)-2-(4-ethoxyphenyl)-4H-isoquinoline-1,3-dione Openeye Name: 4-(butyliminomethyl)-2-(4-ethoxyphenyl)-4H-isoquinoline-1,3-dione CAS Name: 4-(butyliminomethyl)-2-(4-ethoxyphenyl)-4H-isoquinoline-1,3-dione IUPAC Name: 4-(butyliminomethyl)-2-(4-ethoxyphenyl)-4H-isoquinoline-1,3-dione Traditional Name: 4-(butyliminomethyl)-2-p-phenetyl-4H-isoquinoline-1,3-quinone Formula: C22H24N2O3 MolecularWeight: 364.43756

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Descriptors Computed from Structure

Canonical SMILES:

CCCCN=CC1C2=CC=CC=C2C(=O)N(C1=O)C3=CC=C(C=C3)OCC

Isomeric SMILES

CCCCN=CC1C2=CC=CC=C2C(=O)N(C1=O)C3=CC=C(C=C3)OCC

InChI

InChI=1S/C22H24N2O3/c1-3-5-14-23-15-20-18-8-6-7-9-19(18)21(25)24(22(20)26)16-10-12-17(13-11-16)27-4-2/h6-13,15,20H,3-5,14H2,1-2H3