1-[5-[oxidanyl-[2-(3-prop-1-en-2-ylphenyl)propan-2-ylamino]methoxy]pentyl]pyrrole-2,5-dione

Systemtic Name: 1-[5-[oxidanyl-[2-(3-prop-1-en-2-ylphenyl)propan-2-ylamino]methoxy]pentyl]pyrrole-2,5-dione Openeye Name: 1-[5-[hydroxy-[[1-(3-isopropenylphenyl)-1-methyl-ethyl]amino]methoxy]pentyl]pyrrole-2,5-dione CAS Name: 1-[5-[hydroxy-[2-[3-(1-methylethenyl)phenyl]propan-2-ylamino]methoxy]pentyl]pyrrole-2,5-dione IUPAC Name: 1-[5-[hydroxy-[2-(3-prop-1-en-2-ylphenyl)propan-2-ylamino]methoxy]pentyl]pyrrole-2,5-dione Traditional Name: 1-[5-[hydroxy-[[1-(3-isopropenylphenyl)-1-methyl-ethyl]amino]methoxy]pentyl]-3-pyrroline-2,5-quinone Formula: C22H30N2O4 MolecularWeight: 386.4846

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Descriptors Computed from Structure

Canonical SMILES:

CC(=C)C1=CC(=CC=C1)C(C)(C)NC(O)OCCCCCN2C(=O)C=CC2=O

Isomeric SMILES

CC(=C)C1=CC(=CC=C1)C(C)(C)NC(O)OCCCCCN2C(=O)C=CC2=O

InChI

InChI=1S/C22H30N2O4/c1-16(2)17-9-8-10-18(15-17)22(3,4)23-21(27)28-14-7-5-6-13-24-19(25)11-12-20(24)26/h8-12,15,21,23,27H,1,5-7,13-14H2,2-4H3