methyl 4-[2-[cyclopropyl-[(4-fluorophenyl)methyl]amino]ethanoylamino]benzoate

Systemtic Name: methyl 4-[2-[cyclopropyl-[(4-fluorophenyl)methyl]amino]ethanoylamino]benzoate Openeye Name: methyl 4-[[2-[cyclopropyl-[(4-fluorophenyl)methyl]amino]acetyl]amino]benzoate CAS Name: 4-[[2-[cyclopropyl-[(4-fluorophenyl)methyl]amino]-1-oxoethyl]amino]benzoic acid methyl ester IUPAC Name: methyl 4-[[2-[cyclopropyl-[(4-fluorophenyl)methyl]amino]acetyl]amino]benzoate Traditional Name: 4-[[2-[cyclopropyl-(4-fluorobenzyl)amino]acetyl]amino]benzoic acid methyl ester Formula: C20H21FN2O3 MolecularWeight: 356.390743

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1=CC=C(C=C1)NC(=O)CN(CC2=CC=C(C=C2)F)C3CC3

Isomeric SMILES

COC(=O)C1=CC=C(C=C1)NC(=O)CN(CC2=CC=C(C=C2)F)C3CC3

InChI

InChI=1S/C20H21FN2O3/c1-26-20(25)15-4-8-17(9-5-15)22-19(24)13-23(18-10-11-18)12-14-2-6-16(21)7-3-14/h2-9,18H,10-13H2,1H3,(H,22,24)