2-(3,5-dimethylphenoxy)ethyl 4-[(propan-2-ylcarbamoylamino)methyl]benzoate

Systemtic Name: 2-(3,5-dimethylphenoxy)ethyl 4-[(propan-2-ylcarbamoylamino)methyl]benzoate Openeye Name: 2-(3,5-dimethylphenoxy)ethyl 4-[(isopropylcarbamoylamino)methyl]benzoate CAS Name: 4-[[[oxo-(propan-2-ylamino)methyl]amino]methyl]benzoic acid 2-(3,5-dimethylphenoxy)ethyl ester IUPAC Name: 2-(3,5-dimethylphenoxy)ethyl 4-[(propan-2-ylcarbamoylamino)methyl]benzoate Traditional Name: 4-[(isopropylcarbamoylamino)methyl]benzoic acid 2-(3,5-dimethylphenoxy)ethyl ester Formula: C22H28N2O4 MolecularWeight: 384.46872

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC(=C1)OCCOC(=O)C2=CC=C(C=C2)CNC(=O)NC(C)C)C

Isomeric SMILES

CC1=CC(=CC(=C1)OCCOC(=O)C2=CC=C(C=C2)CNC(=O)NC(C)C)C

InChI

InChI=1S/C22H28N2O4/c1-15(2)24-22(26)23-14-18-5-7-19(8-6-18)21(25)28-10-9-27-20-12-16(3)11-17(4)13-20/h5-8,11-13,15H,9-10,14H2,1-4H3,(H2,23,24,26)