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

Systemtic Name: (4R)-4-(2-dimethylaminoethyliminomethyl)-2-(4-ethoxyphenyl)-4H-isoquinoline-1,3-dione Openeye Name: (4R)-4-(2-dimethylaminoethyliminomethyl)-2-(4-ethoxyphenyl)-4H-isoquinoline-1,3-dione CAS Name: (4R)-4-(2-dimethylaminoethyliminomethyl)-2-(4-ethoxyphenyl)-4H-isoquinoline-1,3-dione IUPAC Name: (4R)-4-(2-dimethylaminoethyliminomethyl)-2-(4-ethoxyphenyl)-4H-isoquinoline-1,3-dione Traditional Name: (4R)-4-(2-dimethylaminoethyliminomethyl)-2-p-phenetyl-4H-isoquinoline-1,3-quinone Formula: C22H25N3O3 MolecularWeight: 379.4522

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=CC=C(C=C1)N2C(=O)C(C3=CC=CC=C3C2=O)C=NCCN(C)C

Isomeric SMILES

CCOC1=CC=C(C=C1)N2C(=O)[C@H](C3=CC=CC=C3C2=O)C=NCCN(C)C

InChI

InChI=1S/C22H25N3O3/c1-4-28-17-11-9-16(10-12-17)25-21(26)19-8-6-5-7-18(19)20(22(25)27)15-23-13-14-24(2)3/h5-12,15,20H,4,13-14H2,1-3H3/t20-/m0/s1