[5-aminocarbonyl-2-ethyl-9-(phenylmethyl)-5,6,7,8-tetrahydrocarbazol-3-yl] butaneperoxoate

Systemtic Name: [5-aminocarbonyl-2-ethyl-9-(phenylmethyl)-5,6,7,8-tetrahydrocarbazol-3-yl] butaneperoxoate Openeye Name: (9-benzyl-5-carbamoyl-2-ethyl-5,6,7,8-tetrahydrocarbazol-3-yl) butaneperoxoate CAS Name: butaneperoxoic acid [5-carbamoyl-2-ethyl-9-(phenylmethyl)-5,6,7,8-tetrahydrocarbazol-3-yl] ester IUPAC Name: (9-benzyl-5-carbamoyl-2-ethyl-5,6,7,8-tetrahydrocarbazol-3-yl) butaneperoxoate Traditional Name: peroxybutyric acid (9-benzyl-5-carbamoyl-2-ethyl-5,6,7,8-tetrahydrocarbazol-3-yl) ester Formula: C26H30N2O4 MolecularWeight: 434.5274

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Descriptors Computed from Structure

Canonical SMILES:

CCCC(=O)OOC1=C(C=C2C(=C1)C3=C(N2CC4=CC=CC=C4)CCCC3C(=O)N)CC

Isomeric SMILES

CCCC(=O)OOC1=C(C=C2C(=C1)C3=C(N2CC4=CC=CC=C4)CCCC3C(=O)N)CC

InChI

InChI=1S/C26H30N2O4/c1-3-9-24(29)32-31-23-15-20-22(14-18(23)4-2)28(16-17-10-6-5-7-11-17)21-13-8-12-19(25(20)21)26(27)30/h5-7,10-11,14-15,19H,3-4,8-9,12-13,16H2,1-2H3,(H2,27,30)