6-chloranyl-4-[2-(2,5-dimethyl-1-propyl-pyrrol-3-yl)-2-oxidanylidene-ethyl]-1-(phenylmethyl)quinoxaline-2,3-dione

Systemtic Name: 6-chloranyl-4-[2-(2,5-dimethyl-1-propyl-pyrrol-3-yl)-2-oxidanylidene-ethyl]-1-(phenylmethyl)quinoxaline-2,3-dione Openeye Name: 1-benzyl-6-chloro-4-[2-(2,5-dimethyl-1-propyl-pyrrol-3-yl)-2-oxo-ethyl]quinoxaline-2,3-dione CAS Name: 6-chloro-4-[2-(2,5-dimethyl-1-propyl-3-pyrrolyl)-2-oxoethyl]-1-(phenylmethyl)quinoxaline-2,3-dione IUPAC Name: 1-benzyl-6-chloro-4-[2-(2,5-dimethyl-1-propylpyrrol-3-yl)-2-oxoethyl]quinoxaline-2,3-dione Traditional Name: 1-benzyl-6-chloro-4-[2-(2,5-dimethyl-1-propyl-pyrrol-3-yl)-2-keto-ethyl]quinoxaline-2,3-quinone Formula: C26H26ClN3O3 MolecularWeight: 463.95594

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Descriptors Computed from Structure

Canonical SMILES:

CCCN1C(=CC(=C1C)C(=O)CN2C3=C(C=CC(=C3)Cl)N(C(=O)C2=O)CC4=CC=CC=C4)C

Isomeric SMILES

CCCN1C(=CC(=C1C)C(=O)CN2C3=C(C=CC(=C3)Cl)N(C(=O)C2=O)CC4=CC=CC=C4)C

InChI

InChI=1S/C26H26ClN3O3/c1-4-12-28-17(2)13-21(18(28)3)24(31)16-30-23-14-20(27)10-11-22(23)29(25(32)26(30)33)15-19-8-6-5-7-9-19/h5-11,13-14H,4,12,15-16H2,1-3H3