2-[5-(3-chloranyl-8-methyl-phenanthridin-6-yl)pentyl]isoindole-1,3-dione

Systemtic Name: 2-[5-(3-chloranyl-8-methyl-phenanthridin-6-yl)pentyl]isoindole-1,3-dione Openeye Name: 2-[5-(3-chloro-8-methyl-phenanthridin-6-yl)pentyl]isoindoline-1,3-dione CAS Name: 2-[5-(3-chloro-8-methyl-6-phenanthridinyl)pentyl]isoindole-1,3-dione IUPAC Name: 2-[5-(3-chloro-8-methylphenanthridin-6-yl)pentyl]isoindole-1,3-dione Traditional Name: 2-[5-(3-chloro-8-methyl-phenanthridin-6-yl)pentyl]isoindoline-1,3-quinone Formula: C27H23ClN2O2 MolecularWeight: 442.93672

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC2=C(N=C3C=C(C=CC3=C2C=C1)Cl)CCCCCN4C(=O)C5=CC=CC=C5C4=O

Isomeric SMILES

CC1=CC2=C(N=C3C=C(C=CC3=C2C=C1)Cl)CCCCCN4C(=O)C5=CC=CC=C5C4=O

InChI

InChI=1S/C27H23ClN2O2/c1-17-10-12-19-20-13-11-18(28)16-25(20)29-24(23(19)15-17)9-3-2-6-14-30-26(31)21-7-4-5-8-22(21)27(30)32/h4-5,7-8,10-13,15-16H,2-3,6,9,14H2,1H3