2-[4-[4-(4-hydroxyphenyl)carbonylpiperazin-1-yl]-4-oxidanylidene-butyl]benzo[de]isoquinoline-1,3-dione

Systemtic Name: 2-[4-[4-(4-hydroxyphenyl)carbonylpiperazin-1-yl]-4-oxidanylidene-butyl]benzo[de]isoquinoline-1,3-dione Openeye Name: 2-[4-[4-(4-hydroxybenzoyl)piperazin-1-yl]-4-oxo-butyl]benzo[de]isoquinoline-1,3-dione CAS Name: 2-[4-[4-[(4-hydroxyphenyl)-oxomethyl]-1-piperazinyl]-4-oxobutyl]benzo[de]isoquinoline-1,3-dione IUPAC Name: 2-[4-[4-(4-hydroxybenzoyl)piperazin-1-yl]-4-oxobutyl]benzo[de]isoquinoline-1,3-dione Traditional Name: 2-[4-[4-(4-hydroxybenzoyl)piperazino]-4-keto-butyl]benzo[de]isoquinoline-1,3-quinone Formula: C27H25N3O5 MolecularWeight: 471.5045

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1C(=O)CCCN2C(=O)C3=CC=CC4=C3C(=CC=C4)C2=O)C(=O)C5=CC=C(C=C5)O

Isomeric SMILES

C1CN(CCN1C(=O)CCCN2C(=O)C3=CC=CC4=C3C(=CC=C4)C2=O)C(=O)C5=CC=C(C=C5)O

InChI

InChI=1S/C27H25N3O5/c31-20-11-9-19(10-12-20)25(33)29-16-14-28(15-17-29)23(32)8-3-13-30-26(34)21-6-1-4-18-5-2-7-22(24(18)21)27(30)35/h1-2,4-7,9-12,31H,3,8,13-17H2