methyl 4-[[2-(4-azanylbutoxy)-4-methyl-phenyl]-methyl-carbamoyl]-2-methoxy-benzoate

Systemtic Name: methyl 4-[[2-(4-azanylbutoxy)-4-methyl-phenyl]-methyl-carbamoyl]-2-methoxy-benzoate Openeye Name: methyl 4-[[2-(4-aminobutoxy)-4-methyl-phenyl]-methyl-carbamoyl]-2-methoxy-benzoate CAS Name: 4-[[2-(4-aminobutoxy)-N,4-dimethylanilino]-oxomethyl]-2-methoxybenzoic acid methyl ester IUPAC Name: methyl 4-[[2-(4-aminobutoxy)-4-methylphenyl]-methylcarbamoyl]-2-methoxybenzoate Traditional Name: 4-[[2-(4-aminobutoxy)-4-methyl-phenyl]-methyl-carbamoyl]-2-methoxy-benzoic acid methyl ester Formula: C22H28N2O5 MolecularWeight: 400.46812

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1)N(C)C(=O)C2=CC(=C(C=C2)C(=O)OC)OC)OCCCCN

Isomeric SMILES

CC1=CC(=C(C=C1)N(C)C(=O)C2=CC(=C(C=C2)C(=O)OC)OC)OCCCCN

InChI

InChI=1S/C22H28N2O5/c1-15-7-10-18(20(13-15)29-12-6-5-11-23)24(2)21(25)16-8-9-17(22(26)28-4)19(14-16)27-3/h7-10,13-14H,5-6,11-12,23H2,1-4H3