2-azanylethanol; 3-methyl-6-oxidanyl-5-(2,4,4-trimethylpentyl)cyclohexa-2,4-dien-1-one

Systemtic Name: 2-azanylethanol; 3-methyl-6-oxidanyl-5-(2,4,4-trimethylpentyl)cyclohexa-2,4-dien-1-one Openeye Name: 2-aminoethanol; 6-hydroxy-3-methyl-5-(2,4,4-trimethylpentyl)cyclohexa-2,4-dien-1-one CAS Name: 2-aminoethanol; 6-hydroxy-3-methyl-5-(2,4,4-trimethylpentyl)-1-cyclohexa-2,4-dienone IUPAC Name: 2-aminoethanol; 6-hydroxy-3-methyl-5-(2,4,4-trimethylpentyl)cyclohexa-2,4-dien-1-one Traditional Name: 2-aminoethanol; 6-hydroxy-3-methyl-5-(2,4,4-trimethylpentyl)cyclohexa-2,4-dien-1-one Formula: C17H31NO3 MolecularWeight: 297.43294

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=O)C(C(=C1)CC(C)CC(C)(C)C)O.C(CO)N

Isomeric SMILES

CC1=CC(=O)C(C(=C1)CC(C)CC(C)(C)C)O.C(CO)N

InChI

InChI=1S/C15H24O2.C2H7NO/c1-10-6-12(14(17)13(16)8-10)7-11(2)9-15(3,4)5;3-1-2-4/h6,8,11,14,17H,7,9H2,1-5H3;4H,1-3H2