2-[4-[3-azanylpropyl-(phenylmethyl)amino]butyl]isoindole-1,3-dione

Systemtic Name: 2-[4-[3-azanylpropyl-(phenylmethyl)amino]butyl]isoindole-1,3-dione Openeye Name: 2-[4-[3-aminopropyl(benzyl)amino]butyl]isoindoline-1,3-dione CAS Name: 2-[4-[3-aminopropyl-(phenylmethyl)amino]butyl]isoindole-1,3-dione IUPAC Name: 2-[4-[3-aminopropyl(benzyl)amino]butyl]isoindole-1,3-dione Traditional Name: 2-[4-[3-aminopropyl(benzyl)amino]butyl]isoindoline-1,3-quinone Formula: C22H27N3O2 MolecularWeight: 365.46868

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)CN(CCCCN2C(=O)C3=CC=CC=C3C2=O)CCCN

Isomeric SMILES

C1=CC=C(C=C1)CN(CCCCN2C(=O)C3=CC=CC=C3C2=O)CCCN

InChI

InChI=1S/C22H27N3O2/c23-13-8-15-24(17-18-9-2-1-3-10-18)14-6-7-16-25-21(26)19-11-4-5-12-20(19)22(25)27/h1-5,9-12H,6-8,13-17,23H2