dimethyl 5-(octadecylamino)benzene-1,3-dicarboxylate

Systemtic Name: dimethyl 5-(octadecylamino)benzene-1,3-dicarboxylate Openeye Name: dimethyl 5-(octadecylamino)benzene-1,3-dicarboxylate CAS Name: 5-(octadecylamino)benzene-1,3-dicarboxylic acid dimethyl ester IUPAC Name: dimethyl 5-(octadecylamino)benzene-1,3-dicarboxylate Traditional Name: 5-(stearylamino)benzene-1,3-dicarboxylic acid dimethyl ester Formula: C28H47NO4 MolecularWeight: 461.67708

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCCCCCCCNC1=CC(=CC(=C1)C(=O)OC)C(=O)OC

Isomeric SMILES

CCCCCCCCCCCCCCCCCCNC1=CC(=CC(=C1)C(=O)OC)C(=O)OC

InChI

InChI=1S/C28H47NO4/c1-4-5-6-7-8-9-10-11-12-13-14-15-16-17-18-19-20-29-26-22-24(27(30)32-2)21-25(23-26)28(31)33-3/h21-23,29H,4-20H2,1-3H3