3a,4,4-trimethyl-2,3,9,9a-tetrahydro-1H-benzo[f]indole; 4-methylperoxy-3-oxidanyl-4-oxidanylidene-butanoic acid

Systemtic Name: 3a,4,4-trimethyl-2,3,9,9a-tetrahydro-1H-benzo[f]indole; 4-methylperoxy-3-oxidanyl-4-oxidanylidene-butanoic acid Openeye Name: 3a,4,4-trimethyl-2,3,9,9a-tetrahydro-1H-benzo[f]indole; 3-hydroxy-4-methylperoxy-4-oxo-butanoic acid CAS Name: 3a,4,4-trimethyl-2,3,9,9a-tetrahydro-1H-benzo[f]indole; 3-hydroxy-4-methyldioxy-4-oxobutanoic acid IUPAC Name: 3a,4,4-trimethyl-2,3,9,9a-tetrahydro-1H-benzo[f]indole; 3-hydroxy-4-methylperoxy-4-oxobutanoic acid Traditional Name: 3a,4,4-trimethyl-2,3,9,9a-tetrahydro-1H-benz[f]indole; 3-hydroxy-4-keto-4-methylperoxy-butyric acid Formula: C20H29NO6 MolecularWeight: 379.44736

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Descriptors Computed from Structure

Canonical SMILES:

CC1(C2=CC=CC=C2CC3C1(CCN3)C)C.COOC(=O)C(CC(=O)O)O

Isomeric SMILES

CC1(C2=CC=CC=C2CC3C1(CCN3)C)C.COOC(=O)C(CC(=O)O)O

InChI

InChI=1S/C15H21N.C5H8O6/c1-14(2)12-7-5-4-6-11(12)10-13-15(14,3)8-9-16-13;1-10-11-5(9)3(6)2-4(7)8/h4-7,13,16H,8-10H2,1-3H3;3,6H,2H2,1H3,(H,7,8)