(4S)-4-[2-(4-chlorophenyl)ethyliminomethyl]-2-pyridin-2-yl-4H-isoquinoline-1,3-dione

Systemtic Name: (4S)-4-[2-(4-chlorophenyl)ethyliminomethyl]-2-pyridin-2-yl-4H-isoquinoline-1,3-dione Openeye Name: (4S)-4-[2-(4-chlorophenyl)ethyliminomethyl]-2-(2-pyridyl)-4H-isoquinoline-1,3-dione CAS Name: (4S)-4-[2-(4-chlorophenyl)ethyliminomethyl]-2-(2-pyridinyl)-4H-isoquinoline-1,3-dione IUPAC Name: (4S)-4-[2-(4-chlorophenyl)ethyliminomethyl]-2-pyridin-2-yl-4H-isoquinoline-1,3-dione Traditional Name: (4S)-4-[2-(4-chlorophenyl)ethyliminomethyl]-2-(2-pyridyl)-4H-isoquinoline-1,3-quinone Formula: C23H18ClN3O2 MolecularWeight: 403.86092

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)C(C(=O)N(C2=O)C3=CC=CC=N3)C=NCCC4=CC=C(C=C4)Cl

Isomeric SMILES

C1=CC=C2C(=C1)[C@H](C(=O)N(C2=O)C3=CC=CC=N3)C=NCCC4=CC=C(C=C4)Cl

InChI

InChI=1S/C23H18ClN3O2/c24-17-10-8-16(9-11-17)12-14-25-15-20-18-5-1-2-6-19(18)22(28)27(23(20)29)21-7-3-4-13-26-21/h1-11,13,15,20H,12,14H2/t20-/m1/s1