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

Systemtic Name: [2-(2-methylpropylamino)-2-oxidanylidene-ethyl] 4-[(propan-2-ylcarbamoylamino)methyl]benzoate Openeye Name: [2-(isobutylamino)-2-oxo-ethyl] 4-[(isopropylcarbamoylamino)methyl]benzoate CAS Name: 4-[[[oxo-(propan-2-ylamino)methyl]amino]methyl]benzoic acid [2-(2-methylpropylamino)-2-oxoethyl] ester IUPAC Name: [2-(2-methylpropylamino)-2-oxoethyl] 4-[(propan-2-ylcarbamoylamino)methyl]benzoate Traditional Name: 4-[(isopropylcarbamoylamino)methyl]benzoic acid [2-(isobutylamino)-2-keto-ethyl] ester Formula: C18H27N3O4 MolecularWeight: 349.42468

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CNC(=O)COC(=O)C1=CC=C(C=C1)CNC(=O)NC(C)C

Isomeric SMILES

CC(C)CNC(=O)COC(=O)C1=CC=C(C=C1)CNC(=O)NC(C)C

InChI

InChI=1S/C18H27N3O4/c1-12(2)9-19-16(22)11-25-17(23)15-7-5-14(6-8-15)10-20-18(24)21-13(3)4/h5-8,12-13H,9-11H2,1-4H3,(H,19,22)(H2,20,21,24)