(3S)-3-(5,6-dimethylbenzimidazol-1-yl)-1-(4-propoxyphenyl)pyrrolidine-2,5-dione

Systemtic Name: (3S)-3-(5,6-dimethylbenzimidazol-1-yl)-1-(4-propoxyphenyl)pyrrolidine-2,5-dione Openeye Name: (3S)-3-(5,6-dimethylbenzimidazol-1-yl)-1-(4-propoxyphenyl)pyrrolidine-2,5-dione CAS Name: (3S)-3-(5,6-dimethyl-1-benzimidazolyl)-1-(4-propoxyphenyl)pyrrolidine-2,5-dione IUPAC Name: (3S)-3-(5,6-dimethylbenzimidazol-1-yl)-1-(4-propoxyphenyl)pyrrolidine-2,5-dione Traditional Name: (3S)-3-(5,6-dimethylbenzimidazol-1-yl)-1-(4-propoxyphenyl)pyrrolidine-2,5-quinone Formula: C22H23N3O3 MolecularWeight: 377.43632

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Descriptors Computed from Structure

Canonical SMILES:

CCCOC1=CC=C(C=C1)N2C(=O)CC(C2=O)N3C=NC4=C3C=C(C(=C4)C)C

Isomeric SMILES

CCCOC1=CC=C(C=C1)N2C(=O)C[C@@H](C2=O)N3C=NC4=C3C=C(C(=C4)C)C

InChI

InChI=1S/C22H23N3O3/c1-4-9-28-17-7-5-16(6-8-17)25-21(26)12-20(22(25)27)24-13-23-18-10-14(2)15(3)11-19(18)24/h5-8,10-11,13,20H,4,9,12H2,1-3H3/t20-/m0/s1