octadecyl 3-azanyl-4-methyl-benzoate

Systemtic Name: octadecyl 3-azanyl-4-methyl-benzoate Openeye Name: octadecyl 3-amino-4-methyl-benzoate CAS Name: 3-amino-4-methylbenzoic acid octadecyl ester IUPAC Name: octadecyl 3-amino-4-methylbenzoate Traditional Name: 3-amino-4-methyl-benzoic acid stearyl ester Formula: C26H45NO2 MolecularWeight: 403.641

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCCCCCCCOC(=O)C1=CC(=C(C=C1)C)N

Isomeric SMILES

CCCCCCCCCCCCCCCCCCOC(=O)C1=CC(=C(C=C1)C)N

InChI

InChI=1S/C26H45NO2/c1-3-4-5-6-7-8-9-10-11-12-13-14-15-16-17-18-21-29-26(28)24-20-19-23(2)25(27)22-24/h19-20,22H,3-18,21,27H2,1-2H3