2,4-di(nonyl)phenol; ethane-1,2-diamine; methanal; 4-nonylphenol

Systemtic Name: 2,4-di(nonyl)phenol; ethane-1,2-diamine; methanal; 4-nonylphenol Openeye Name: 2,4-di(nonyl)phenol; ethane-1,2-diamine; formaldehyde; 4-nonylphenol CAS Name: 2,4-di(nonyl)phenol; ethane-1,2-diamine; formaldehyde; 4-nonylphenol IUPAC Name: 2,4-di(nonyl)phenol; ethane-1,2-diamine; formaldehyde; 4-nonylphenol Traditional Name: 2-aminoethylamine; 2,4-di(nonyl)phenol; formaldehyde; 4-nonylphenol Formula: C42H76N2O3 MolecularWeight: 657.06444

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCC1=CC=C(C=C1)O.CCCCCCCCCC1=CC(=C(C=C1)O)CCCCCCCCC.C=O.C(CN)N

Isomeric SMILES

CCCCCCCCCC1=CC=C(C=C1)O.CCCCCCCCCC1=CC(=C(C=C1)O)CCCCCCCCC.C=O.C(CN)N

InChI

InChI=1S/C24H42O.C15H24O.C2H8N2.CH2O/c1-3-5-7-9-11-13-15-17-22-19-20-24(25)23(21-22)18-16-14-12-10-8-6-4-2;1-2-3-4-5-6-7-8-9-14-10-12-15(16)13-11-14;3-1-2-4;1-2/h19-21,25H,3-18H2,1-2H3;10-13,16H,2-9H2,1H3;1-4H2;1H2