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4-azanyl-2-(3-propan-2-yloxyhexadecyl)benzoate

4-azanyl-2-(3-propan-2-yloxyhexadecyl)benzoate

Systemtic Name:4-azanyl-2-(3-propan-2-yloxyhexadecyl)benzoate
Openeye Name:4-amino-2-(3-isopropoxyhexadecyl)benzoate
CAS Name:4-amino-2-(3-propan-2-yloxyhexadecyl)benzoate
IUPAC Name:4-amino-2-(3-propan-2-yloxyhexadecyl)benzoate
Traditional Name:4-amino-2-(3-isopropoxyhexadecyl)benzoate
Formula: C26H44NO3-
MolecularWeight: 418.63246
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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCCC(CCC1=C(C=CC(=C1)N)C(=O)[O-])OC(C)C


Isomeric SMILES

CCCCCCCCCCCCCC(CCC1=C(C=CC(=C1)N)C(=O)[O-])OC(C)C


InChI

InChI=1S/C26H45NO3/c1-4-5-6-7-8-9-10-11-12-13-14-15-24(30-21(2)3)18-16-22-20-23(27)17-19-25(22)26(28)29/h17,19-21,24H,4-16,18,27H2,1-3H3,(H,28,29)/p-1


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