3-chloranyl-4-(cyclododecylamino)-1-phenyl-pyrrole-2,5-dione

Systemtic Name: 3-chloranyl-4-(cyclododecylamino)-1-phenyl-pyrrole-2,5-dione Openeye Name: 3-chloro-4-(cyclododecylamino)-1-phenyl-pyrrole-2,5-dione CAS Name: 3-chloro-4-(cyclododecylamino)-1-phenylpyrrole-2,5-dione IUPAC Name: 3-chloro-4-(cyclododecylamino)-1-phenylpyrrole-2,5-dione Traditional Name: 3-chloro-4-(cyclododecylamino)-1-phenyl-3-pyrroline-2,5-quinone Formula: C22H29ClN2O2 MolecularWeight: 388.93086

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Descriptors Computed from Structure

Canonical SMILES:

C1CCCCCC(CCCCC1)NC2=C(C(=O)N(C2=O)C3=CC=CC=C3)Cl

Isomeric SMILES

C1CCCCCC(CCCCC1)NC2=C(C(=O)N(C2=O)C3=CC=CC=C3)Cl

InChI

InChI=1S/C22H29ClN2O2/c23-19-20(22(27)25(21(19)26)18-15-11-8-12-16-18)24-17-13-9-6-4-2-1-3-5-7-10-14-17/h8,11-12,15-17,24H,1-7,9-10,13-14H2