2-[3-[4-(4-methyl-3-oxidanylidene-1,4-benzoxazin-7-yl)butylamino]propyl]isoindole-1,3-dione

Systemtic Name: 2-[3-[4-(4-methyl-3-oxidanylidene-1,4-benzoxazin-7-yl)butylamino]propyl]isoindole-1,3-dione Openeye Name: 2-[3-[4-(4-methyl-3-oxo-1,4-benzoxazin-7-yl)butylamino]propyl]isoindoline-1,3-dione CAS Name: 2-[3-[4-(4-methyl-3-oxo-1,4-benzoxazin-7-yl)butylamino]propyl]isoindole-1,3-dione IUPAC Name: 2-[3-[4-(4-methyl-3-oxo-1,4-benzoxazin-7-yl)butylamino]propyl]isoindole-1,3-dione Traditional Name: 2-[3-[4-(3-keto-4-methyl-1,4-benzoxazin-7-yl)butylamino]propyl]isoindoline-1,3-quinone Formula: C24H27N3O4 MolecularWeight: 421.48888

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Descriptors Computed from Structure

Canonical SMILES:

CN1C(=O)COC2=C1C=CC(=C2)CCCCNCCCN3C(=O)C4=CC=CC=C4C3=O

Isomeric SMILES

CN1C(=O)COC2=C1C=CC(=C2)CCCCNCCCN3C(=O)C4=CC=CC=C4C3=O

InChI

InChI=1S/C24H27N3O4/c1-26-20-11-10-17(15-21(20)31-16-22(26)28)7-4-5-12-25-13-6-14-27-23(29)18-8-2-3-9-19(18)24(27)30/h2-3,8-11,15,25H,4-7,12-14,16H2,1H3