(4-cyanophenyl)methyl 4-[(propan-2-ylcarbamoylamino)methyl]benzoate

Systemtic Name: (4-cyanophenyl)methyl 4-[(propan-2-ylcarbamoylamino)methyl]benzoate Openeye Name: (4-cyanophenyl)methyl 4-[(isopropylcarbamoylamino)methyl]benzoate CAS Name: 4-[[[oxo-(propan-2-ylamino)methyl]amino]methyl]benzoic acid (4-cyanophenyl)methyl ester IUPAC Name: (4-cyanophenyl)methyl 4-[(propan-2-ylcarbamoylamino)methyl]benzoate Traditional Name: 4-[(isopropylcarbamoylamino)methyl]benzoic acid (4-cyanobenzyl) ester Formula: C20H21N3O3 MolecularWeight: 351.39904

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)NC(=O)NCC1=CC=C(C=C1)C(=O)OCC2=CC=C(C=C2)C#N

Isomeric SMILES

CC(C)NC(=O)NCC1=CC=C(C=C1)C(=O)OCC2=CC=C(C=C2)C#N

InChI

InChI=1S/C20H21N3O3/c1-14(2)23-20(25)22-12-16-7-9-18(10-8-16)19(24)26-13-17-5-3-15(11-21)4-6-17/h3-10,14H,12-13H2,1-2H3,(H2,22,23,25)