2-[4-oxidanylidene-4-[4-(quinolin-8-ylmethyl)piperazin-1-yl]butyl]benzo[de]isoquinoline-1,3-dione

Systemtic Name: 2-[4-oxidanylidene-4-[4-(quinolin-8-ylmethyl)piperazin-1-yl]butyl]benzo[de]isoquinoline-1,3-dione Openeye Name: 2-[4-oxo-4-[4-(8-quinolylmethyl)piperazin-1-yl]butyl]benzo[de]isoquinoline-1,3-dione CAS Name: 2-[4-oxo-4-[4-(8-quinolinylmethyl)-1-piperazinyl]butyl]benzo[de]isoquinoline-1,3-dione IUPAC Name: 2-[4-oxo-4-[4-(quinolin-8-ylmethyl)piperazin-1-yl]butyl]benzo[de]isoquinoline-1,3-dione Traditional Name: 2-[4-keto-4-[4-(8-quinolylmethyl)piperazino]butyl]benzo[de]isoquinoline-1,3-quinone Formula: C30H28N4O3 MolecularWeight: 492.56832

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1CC2=CC=CC3=C2N=CC=C3)C(=O)CCCN4C(=O)C5=CC=CC6=C5C(=CC=C6)C4=O

Isomeric SMILES

C1CN(CCN1CC2=CC=CC3=C2N=CC=C3)C(=O)CCCN4C(=O)C5=CC=CC6=C5C(=CC=C6)C4=O

InChI

InChI=1S/C30H28N4O3/c35-26(33-18-16-32(17-19-33)20-23-9-1-8-22-10-4-14-31-28(22)23)13-5-15-34-29(36)24-11-2-6-21-7-3-12-25(27(21)24)30(34)37/h1-4,6-12,14H,5,13,15-20H2