2-[1-[4-[(6-methylpyridin-2-yl)methyl]-1,4-diazepan-1-yl]-1-oxidanylidene-propan-2-yl]isoindole-1,3-dione

Systemtic Name: 2-[1-[4-[(6-methylpyridin-2-yl)methyl]-1,4-diazepan-1-yl]-1-oxidanylidene-propan-2-yl]isoindole-1,3-dione Openeye Name: 2-[1-methyl-2-[4-[(6-methyl-2-pyridyl)methyl]-1,4-diazepan-1-yl]-2-oxo-ethyl]isoindoline-1,3-dione CAS Name: 2-[1-[4-[(6-methyl-2-pyridinyl)methyl]-1,4-diazepan-1-yl]-1-oxopropan-2-yl]isoindole-1,3-dione IUPAC Name: 2-[1-[4-[(6-methylpyridin-2-yl)methyl]-1,4-diazepan-1-yl]-1-oxopropan-2-yl]isoindole-1,3-dione Traditional Name: 2-[2-keto-1-methyl-2-[4-[(6-methyl-2-pyridyl)methyl]-1,4-diazepan-1-yl]ethyl]isoindoline-1,3-quinone Formula: C23H26N4O3 MolecularWeight: 406.47754

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NC(=CC=C1)CN2CCCN(CC2)C(=O)C(C)N3C(=O)C4=CC=CC=C4C3=O

Isomeric SMILES

CC1=NC(=CC=C1)CN2CCCN(CC2)C(=O)C(C)N3C(=O)C4=CC=CC=C4C3=O

InChI

InChI=1S/C23H26N4O3/c1-16-7-5-8-18(24-16)15-25-11-6-12-26(14-13-25)21(28)17(2)27-22(29)19-9-3-4-10-20(19)23(27)30/h3-5,7-10,17H,6,11-15H2,1-2H3