(4S)-4-(2-hydroxyethyliminomethyl)-2-(3-methoxyphenyl)-4H-isoquinoline-1,3-dione

Systemtic Name: (4S)-4-(2-hydroxyethyliminomethyl)-2-(3-methoxyphenyl)-4H-isoquinoline-1,3-dione Openeye Name: (4S)-4-(2-hydroxyethyliminomethyl)-2-(3-methoxyphenyl)-4H-isoquinoline-1,3-dione CAS Name: (4S)-4-(2-hydroxyethyliminomethyl)-2-(3-methoxyphenyl)-4H-isoquinoline-1,3-dione IUPAC Name: (4S)-4-(2-hydroxyethyliminomethyl)-2-(3-methoxyphenyl)-4H-isoquinoline-1,3-dione Traditional Name: (4S)-4-(2-hydroxyethyliminomethyl)-2-(3-methoxyphenyl)-4H-isoquinoline-1,3-quinone Formula: C19H18N2O4 MolecularWeight: 338.35722

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=CC(=C1)N2C(=O)C(C3=CC=CC=C3C2=O)C=NCCO

Isomeric SMILES

COC1=CC=CC(=C1)N2C(=O)[C@@H](C3=CC=CC=C3C2=O)C=NCCO

InChI

InChI=1S/C19H18N2O4/c1-25-14-6-4-5-13(11-14)21-18(23)16-8-3-2-7-15(16)17(19(21)24)12-20-9-10-22/h2-8,11-12,17,22H,9-10H2,1H3/t17-/m1/s1