4-(acridin-9-ylamino)-1-[3-(chloromethyl)-6-oxidanyl-2,3-dihydroindol-1-yl]butan-1-one

Systemtic Name: 4-(acridin-9-ylamino)-1-[3-(chloromethyl)-6-oxidanyl-2,3-dihydroindol-1-yl]butan-1-one Openeye Name: 4-(acridin-9-ylamino)-1-[3-(chloromethyl)-6-hydroxy-indolin-1-yl]butan-1-one CAS Name: 4-(9-acridinylamino)-1-[3-(chloromethyl)-6-hydroxy-2,3-dihydroindol-1-yl]-1-butanone IUPAC Name: 4-(acridin-9-ylamino)-1-[3-(chloromethyl)-6-hydroxy-2,3-dihydroindol-1-yl]butan-1-one Traditional Name: 4-(acridin-9-ylamino)-1-[3-(chloromethyl)-6-hydroxy-indolin-1-yl]butan-1-one Formula: C26H24ClN3O2 MolecularWeight: 445.94066

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Descriptors Computed from Structure

Canonical SMILES:

C1C(C2=C(N1C(=O)CCCNC3=C4C=CC=CC4=NC5=CC=CC=C53)C=C(C=C2)O)CCl

Isomeric SMILES

C1C(C2=C(N1C(=O)CCCNC3=C4C=CC=CC4=NC5=CC=CC=C53)C=C(C=C2)O)CCl

InChI

InChI=1S/C26H24ClN3O2/c27-15-17-16-30(24-14-18(31)11-12-19(17)24)25(32)10-5-13-28-26-20-6-1-3-8-22(20)29-23-9-4-2-7-21(23)26/h1-4,6-9,11-12,14,17,31H,5,10,13,15-16H2,(H,28,29)