3-chloranyl-4-(cyclooctylamino)-1-phenethyl-pyrrole-2,5-dione

Systemtic Name: 3-chloranyl-4-(cyclooctylamino)-1-phenethyl-pyrrole-2,5-dione Openeye Name: 3-chloro-4-(cyclooctylamino)-1-phenethyl-pyrrole-2,5-dione CAS Name: 3-chloro-4-(cyclooctylamino)-1-phenethylpyrrole-2,5-dione IUPAC Name: 3-chloro-4-(cyclooctylamino)-1-phenethylpyrrole-2,5-dione Traditional Name: 3-chloro-4-(cyclooctylamino)-1-phenethyl-3-pyrroline-2,5-quinone Formula: C20H25ClN2O2 MolecularWeight: 360.8777

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Descriptors Computed from Structure

Canonical SMILES:

C1CCCC(CCC1)NC2=C(C(=O)N(C2=O)CCC3=CC=CC=C3)Cl

Isomeric SMILES

C1CCCC(CCC1)NC2=C(C(=O)N(C2=O)CCC3=CC=CC=C3)Cl

InChI

InChI=1S/C20H25ClN2O2/c21-17-18(22-16-11-7-2-1-3-8-12-16)20(25)23(19(17)24)14-13-15-9-5-4-6-10-15/h4-6,9-10,16,22H,1-3,7-8,11-14H2