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

Systemtic Name: (4S)-4-(cyclopropyliminomethyl)-2-(4-ethoxyphenyl)-4H-isoquinoline-1,3-dione Openeye Name: (4S)-4-(cyclopropyliminomethyl)-2-(4-ethoxyphenyl)-4H-isoquinoline-1,3-dione CAS Name: (4S)-4-(cyclopropyliminomethyl)-2-(4-ethoxyphenyl)-4H-isoquinoline-1,3-dione IUPAC Name: (4S)-4-(cyclopropyliminomethyl)-2-(4-ethoxyphenyl)-4H-isoquinoline-1,3-dione Traditional Name: (4S)-4-(cyclopropyliminomethyl)-2-p-phenetyl-4H-isoquinoline-1,3-quinone Formula: C21H20N2O3 MolecularWeight: 348.3951

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=CC=C(C=C1)N2C(=O)C(C3=CC=CC=C3C2=O)C=NC4CC4

Isomeric SMILES

CCOC1=CC=C(C=C1)N2C(=O)[C@@H](C3=CC=CC=C3C2=O)C=NC4CC4

InChI

InChI=1S/C21H20N2O3/c1-2-26-16-11-9-15(10-12-16)23-20(24)18-6-4-3-5-17(18)19(21(23)25)13-22-14-7-8-14/h3-6,9-14,19H,2,7-8H2,1H3/t19-/m1/s1