2-[2-oxidanyl-3-[(phenylmethyl)amino]propyl]isoindole-1,3-dione

Systemtic Name: 2-[2-oxidanyl-3-[(phenylmethyl)amino]propyl]isoindole-1,3-dione Openeye Name: 2-[3-(benzylamino)-2-hydroxy-propyl]isoindoline-1,3-dione CAS Name: 2-[2-hydroxy-3-[(phenylmethyl)amino]propyl]isoindole-1,3-dione IUPAC Name: 2-[3-(benzylamino)-2-hydroxypropyl]isoindole-1,3-dione Traditional Name: 2-[3-(benzylamino)-2-hydroxy-propyl]isoindoline-1,3-quinone Formula: C18H18N2O3 MolecularWeight: 310.34712

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)CNCC(CN2C(=O)C3=CC=CC=C3C2=O)O

Isomeric SMILES

C1=CC=C(C=C1)CNCC(CN2C(=O)C3=CC=CC=C3C2=O)O

InChI

InChI=1S/C18H18N2O3/c21-14(11-19-10-13-6-2-1-3-7-13)12-20-17(22)15-8-4-5-9-16(15)18(20)23/h1-9,14,19,21H,10-12H2