3-[5-chloranyl-1-[3-(dimethylamino)-2-oxidanyl-propyl]indazol-3-yl]-4-(1-methylindol-3-yl)pyrrole-2,5-dione

Systemtic Name: 3-[5-chloranyl-1-[3-(dimethylamino)-2-oxidanyl-propyl]indazol-3-yl]-4-(1-methylindol-3-yl)pyrrole-2,5-dione Openeye Name: 3-[5-chloro-1-[3-(dimethylamino)-2-hydroxy-propyl]indazol-3-yl]-4-(1-methylindol-3-yl)pyrrole-2,5-dione CAS Name: 3-[5-chloro-1-[3-(dimethylamino)-2-hydroxypropyl]-3-indazolyl]-4-(1-methyl-3-indolyl)pyrrole-2,5-dione IUPAC Name: 3-[5-chloro-1-[3-(dimethylamino)-2-hydroxypropyl]indazol-3-yl]-4-(1-methylindol-3-yl)pyrrole-2,5-dione Traditional Name: 3-[5-chloro-1-[3-(dimethylamino)-2-hydroxy-propyl]indazol-3-yl]-4-(1-methylindol-3-yl)-3-pyrroline-2,5-quinone Formula: C25H24ClN5O3 MolecularWeight: 477.94276

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Descriptors Computed from Structure

Canonical SMILES:

CN1C=C(C2=CC=CC=C21)C3=C(C(=O)NC3=O)C4=NN(C5=C4C=C(C=C5)Cl)CC(CN(C)C)O

Isomeric SMILES

CN1C=C(C2=CC=CC=C21)C3=C(C(=O)NC3=O)C4=NN(C5=C4C=C(C=C5)Cl)CC(CN(C)C)O

InChI

InChI=1S/C25H24ClN5O3/c1-29(2)11-15(32)12-31-20-9-8-14(26)10-17(20)23(28-31)22-21(24(33)27-25(22)34)18-13-30(3)19-7-5-4-6-16(18)19/h4-10,13,15,32H,11-12H2,1-3H3,(H,27,33,34)