1-butyl-3-[(phenylmethyl)amino]pyrrole-2,5-dione

Systemtic Name: 1-butyl-3-[(phenylmethyl)amino]pyrrole-2,5-dione Openeye Name: 3-(benzylamino)-1-butyl-pyrrole-2,5-dione CAS Name: 1-butyl-3-[(phenylmethyl)amino]pyrrole-2,5-dione IUPAC Name: 3-(benzylamino)-1-butylpyrrole-2,5-dione Traditional Name: 3-(benzylamino)-1-butyl-3-pyrroline-2,5-quinone Formula: C15H18N2O2 MolecularWeight: 258.31562

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Descriptors Computed from Structure

Canonical SMILES:

CCCCN1C(=O)C=C(C1=O)NCC2=CC=CC=C2

Isomeric SMILES

CCCCN1C(=O)C=C(C1=O)NCC2=CC=CC=C2

InChI

InChI=1S/C15H18N2O2/c1-2-3-9-17-14(18)10-13(15(17)19)16-11-12-7-5-4-6-8-12/h4-8,10,16H,2-3,9,11H2,1H3