1-(4-butylphenyl)-3-chloranyl-4-(3,4-dihydro-1H-isoquinolin-2-yl)pyrrole-2,5-dione

Systemtic Name: 1-(4-butylphenyl)-3-chloranyl-4-(3,4-dihydro-1H-isoquinolin-2-yl)pyrrole-2,5-dione Openeye Name: 1-(4-butylphenyl)-3-chloro-4-(3,4-dihydro-1H-isoquinolin-2-yl)pyrrole-2,5-dione CAS Name: 1-(4-butylphenyl)-3-chloro-4-(3,4-dihydro-1H-isoquinolin-2-yl)pyrrole-2,5-dione IUPAC Name: 1-(4-butylphenyl)-3-chloro-4-(3,4-dihydro-1H-isoquinolin-2-yl)pyrrole-2,5-dione Traditional Name: 1-(4-butylphenyl)-3-chloro-4-(3,4-dihydro-1H-isoquinolin-2-yl)-3-pyrroline-2,5-quinone Formula: C23H23ClN2O2 MolecularWeight: 394.89392

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC1=CC=C(C=C1)N2C(=O)C(=C(C2=O)Cl)N3CCC4=CC=CC=C4C3

Isomeric SMILES

CCCCC1=CC=C(C=C1)N2C(=O)C(=C(C2=O)Cl)N3CCC4=CC=CC=C4C3

InChI

InChI=1S/C23H23ClN2O2/c1-2-3-6-16-9-11-19(12-10-16)26-22(27)20(24)21(23(26)28)25-14-13-17-7-4-5-8-18(17)15-25/h4-5,7-12H,2-3,6,13-15H2,1H3