4-azanyl-3,5-bis(2-ethylhexyl)phthalate

Systemtic Name: 4-azanyl-3,5-bis(2-ethylhexyl)phthalate Openeye Name: 4-amino-3,5-bis(2-ethylhexyl)phthalate CAS Name: 4-amino-3,5-bis(2-ethylhexyl)phthalate IUPAC Name: 4-amino-3,5-bis(2-ethylhexyl)phthalate Traditional Name: 4-amino-3,5-bis(2-ethylhexyl)phthalate Formula: C24H37NO4-2 MolecularWeight: 403.55488

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC(CC)CC1=C(C(=C(C(=C1)C(=O)[O-])C(=O)[O-])CC(CC)CCCC)N

Isomeric SMILES

CCCCC(CC)CC1=C(C(=C(C(=C1)C(=O)[O-])C(=O)[O-])CC(CC)CCCC)N

InChI

InChI=1S/C24H39NO4/c1-5-9-11-16(7-3)13-18-15-20(23(26)27)21(24(28)29)19(22(18)25)14-17(8-4)12-10-6-2/h15-17H,5-14,25H2,1-4H3,(H,26,27)(H,28,29)/p-2