2-(4-cyanophenoxy)ethyl 4-[(propan-2-ylcarbamoylamino)methyl]benzoate

Systemtic Name: 2-(4-cyanophenoxy)ethyl 4-[(propan-2-ylcarbamoylamino)methyl]benzoate Openeye Name: 2-(4-cyanophenoxy)ethyl 4-[(isopropylcarbamoylamino)methyl]benzoate CAS Name: 4-[[[oxo-(propan-2-ylamino)methyl]amino]methyl]benzoic acid 2-(4-cyanophenoxy)ethyl ester IUPAC Name: 2-(4-cyanophenoxy)ethyl 4-[(propan-2-ylcarbamoylamino)methyl]benzoate Traditional Name: 4-[(isopropylcarbamoylamino)methyl]benzoic acid 2-(4-cyanophenoxy)ethyl ester Formula: C21H23N3O4 MolecularWeight: 381.42502

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)NC(=O)NCC1=CC=C(C=C1)C(=O)OCCOC2=CC=C(C=C2)C#N

Isomeric SMILES

CC(C)NC(=O)NCC1=CC=C(C=C1)C(=O)OCCOC2=CC=C(C=C2)C#N

InChI

InChI=1S/C21H23N3O4/c1-15(2)24-21(26)23-14-17-3-7-18(8-4-17)20(25)28-12-11-27-19-9-5-16(13-22)6-10-19/h3-10,15H,11-12,14H2,1-2H3,(H2,23,24,26)