methyl 2-[methyl(2-octoxyethanoyl)amino]-4-[(phenylmethyl)amino]benzoate

Systemtic Name: methyl 2-[methyl(2-octoxyethanoyl)amino]-4-[(phenylmethyl)amino]benzoate Openeye Name: methyl 4-(benzylamino)-2-[methyl-(2-octoxyacetyl)amino]benzoate CAS Name: 2-[methyl-(2-octoxy-1-oxoethyl)amino]-4-[(phenylmethyl)amino]benzoic acid methyl ester IUPAC Name: methyl 4-(benzylamino)-2-[methyl-(2-octoxyacetyl)amino]benzoate Traditional Name: 4-(benzylamino)-2-[methyl-(2-octoxyacetyl)amino]benzoic acid methyl ester Formula: C26H36N2O4 MolecularWeight: 440.57504

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCOCC(=O)N(C)C1=C(C=CC(=C1)NCC2=CC=CC=C2)C(=O)OC

Isomeric SMILES

CCCCCCCCOCC(=O)N(C)C1=C(C=CC(=C1)NCC2=CC=CC=C2)C(=O)OC

InChI

InChI=1S/C26H36N2O4/c1-4-5-6-7-8-12-17-32-20-25(29)28(2)24-18-22(15-16-23(24)26(30)31-3)27-19-21-13-10-9-11-14-21/h9-11,13-16,18,27H,4-8,12,17,19-20H2,1-3H3