2-[2-[4-(2-propylpentanoyl)piperazin-1-yl]ethyl]benzo[de]isoquinoline-1,3-dione

Systemtic Name: 2-[2-[4-(2-propylpentanoyl)piperazin-1-yl]ethyl]benzo[de]isoquinoline-1,3-dione Openeye Name: 2-[2-[4-(2-propylpentanoyl)piperazin-1-yl]ethyl]benzo[de]isoquinoline-1,3-dione CAS Name: 2-[2-[4-(1-oxo-2-propylpentyl)-1-piperazinyl]ethyl]benzo[de]isoquinoline-1,3-dione IUPAC Name: 2-[2-[4-(2-propylpentanoyl)piperazin-1-yl]ethyl]benzo[de]isoquinoline-1,3-dione Traditional Name: 2-[2-[4-(2-propylpentanoyl)piperazino]ethyl]benzo[de]isoquinoline-1,3-quinone Formula: C26H33N3O3 MolecularWeight: 435.55852

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Descriptors Computed from Structure

Canonical SMILES:

CCCC(CCC)C(=O)N1CCN(CC1)CCN2C(=O)C3=CC=CC4=C3C(=CC=C4)C2=O

Isomeric SMILES

CCCC(CCC)C(=O)N1CCN(CC1)CCN2C(=O)C3=CC=CC4=C3C(=CC=C4)C2=O

InChI

InChI=1S/C26H33N3O3/c1-3-7-20(8-4-2)24(30)28-16-13-27(14-17-28)15-18-29-25(31)21-11-5-9-19-10-6-12-22(23(19)21)26(29)32/h5-6,9-12,20H,3-4,7-8,13-18H2,1-2H3