2-(3-chlorophenyl)-4-[(4-ethylpiperazin-1-yl)methylidene]isoquinoline-1,3-dione

Systemtic Name: 2-(3-chlorophenyl)-4-[(4-ethylpiperazin-1-yl)methylidene]isoquinoline-1,3-dione Openeye Name: 2-(3-chlorophenyl)-4-[(4-ethylpiperazin-1-yl)methylene]isoquinoline-1,3-dione CAS Name: 2-(3-chlorophenyl)-4-[(4-ethyl-1-piperazinyl)methylidene]isoquinoline-1,3-dione IUPAC Name: 2-(3-chlorophenyl)-4-[(4-ethylpiperazin-1-yl)methylidene]isoquinoline-1,3-dione Traditional Name: 2-(3-chlorophenyl)-4-[(4-ethylpiperazino)methylene]isoquinoline-1,3-quinone Formula: C22H22ClN3O2 MolecularWeight: 395.88198

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Descriptors Computed from Structure

Canonical SMILES:

CCN1CCN(CC1)C=C2C3=CC=CC=C3C(=O)N(C2=O)C4=CC(=CC=C4)Cl

Isomeric SMILES

CCN1CCN(CC1)C=C2C3=CC=CC=C3C(=O)N(C2=O)C4=CC(=CC=C4)Cl

InChI

InChI=1S/C22H22ClN3O2/c1-2-24-10-12-25(13-11-24)15-20-18-8-3-4-9-19(18)21(27)26(22(20)28)17-7-5-6-16(23)14-17/h3-9,14-15H,2,10-13H2,1H3