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

Systemtic Name: (4S)-4-[(3-chlorophenyl)methyliminomethyl]-2-pyridin-2-yl-4H-isoquinoline-1,3-dione Openeye Name: (4S)-4-[(3-chlorophenyl)methyliminomethyl]-2-(2-pyridyl)-4H-isoquinoline-1,3-dione CAS Name: (4S)-4-[(3-chlorophenyl)methyliminomethyl]-2-(2-pyridinyl)-4H-isoquinoline-1,3-dione IUPAC Name: (4S)-4-[(3-chlorophenyl)methyliminomethyl]-2-pyridin-2-yl-4H-isoquinoline-1,3-dione Traditional Name: (4S)-4-[(3-chlorobenzyl)iminomethyl]-2-(2-pyridyl)-4H-isoquinoline-1,3-quinone Formula: C22H16ClN3O2 MolecularWeight: 389.83434

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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=NCC4=CC(=CC=C4)Cl

Isomeric SMILES

C1=CC=C2C(=C1)[C@H](C(=O)N(C2=O)C3=CC=CC=N3)C=NCC4=CC(=CC=C4)Cl

InChI

InChI=1S/C22H16ClN3O2/c23-16-7-5-6-15(12-16)13-24-14-19-17-8-1-2-9-18(17)21(27)26(22(19)28)20-10-3-4-11-25-20/h1-12,14,19H,13H2/t19-/m1/s1