1-[4-[1-(1,3-benzodioxol-5-yl)propan-2-ylamino]butyl]pyrrole-2,5-dione

Systemtic Name: 1-[4-[1-(1,3-benzodioxol-5-yl)propan-2-ylamino]butyl]pyrrole-2,5-dione Openeye Name: 1-[4-[[2-(1,3-benzodioxol-5-yl)-1-methyl-ethyl]amino]butyl]pyrrole-2,5-dione CAS Name: 1-[4-[1-(1,3-benzodioxol-5-yl)propan-2-ylamino]butyl]pyrrole-2,5-dione IUPAC Name: 1-[4-[1-(1,3-benzodioxol-5-yl)propan-2-ylamino]butyl]pyrrole-2,5-dione Traditional Name: 1-[4-[[2-(1,3-benzodioxol-5-yl)-1-methyl-ethyl]amino]butyl]-3-pyrroline-2,5-quinone Formula: C18H22N2O4 MolecularWeight: 330.37828

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Descriptors Computed from Structure

Canonical SMILES:

CC(CC1=CC2=C(C=C1)OCO2)NCCCCN3C(=O)C=CC3=O

Isomeric SMILES

CC(CC1=CC2=C(C=C1)OCO2)NCCCCN3C(=O)C=CC3=O

InChI

InChI=1S/C18H22N2O4/c1-13(10-14-4-5-15-16(11-14)24-12-23-15)19-8-2-3-9-20-17(21)6-7-18(20)22/h4-7,11,13,19H,2-3,8-10,12H2,1H3