4-tert-butylphenol; 2,3-di(nonyl)phenol; methanal; 2-nonylphenol; oxirane

Systemtic Name: 4-tert-butylphenol; 2,3-di(nonyl)phenol; methanal; 2-nonylphenol; oxirane Openeye Name: 4-tert-butylphenol; 2,3-di(nonyl)phenol; formaldehyde; 2-nonylphenol; oxirane CAS Name: 4-tert-butylphenol; 2,3-di(nonyl)phenol; formaldehyde; 2-nonylphenol; oxirane IUPAC Name: 4-tert-butylphenol; 2,3-di(nonyl)phenol; formaldehyde; 2-nonylphenol; oxirane Traditional Name: 4-tert-butylphenol; 2,3-di(nonyl)phenol; ethylene oxide; formaldehyde; 2-nonylphenol Formula: C52H86O5 MolecularWeight: 791.23624

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCC1=C(C(=CC=C1)O)CCCCCCCCC.CCCCCCCCCC1=CC=CC=C1O.CC(C)(C)C1=CC=C(C=C1)O.C=O.C1CO1

Isomeric SMILES

CCCCCCCCCC1=C(C(=CC=C1)O)CCCCCCCCC.CCCCCCCCCC1=CC=CC=C1O.CC(C)(C)C1=CC=C(C=C1)O.C=O.C1CO1

InChI

InChI=1S/C24H42O.C15H24O.C10H14O.C2H4O.CH2O/c1-3-5-7-9-11-13-15-18-22-19-17-21-24(25)23(22)20-16-14-12-10-8-6-4-2;1-2-3-4-5-6-7-8-11-14-12-9-10-13-15(14)16;1-10(2,3)8-4-6-9(11)7-5-8;1-2-3-1;1-2/h17,19,21,25H,3-16,18,20H2,1-2H3;9-10,12-13,16H,2-8,11H2,1H3;4-7,11H,1-3H3;1-2H2;1H2