[2-(3-methylbutylamino)-2-oxidanylidene-ethyl] 4-[(propan-2-ylcarbamoylamino)methyl]benzoate

Systemtic Name: [2-(3-methylbutylamino)-2-oxidanylidene-ethyl] 4-[(propan-2-ylcarbamoylamino)methyl]benzoate Openeye Name: [2-(isopentylamino)-2-oxo-ethyl] 4-[(isopropylcarbamoylamino)methyl]benzoate CAS Name: 4-[[[oxo-(propan-2-ylamino)methyl]amino]methyl]benzoic acid [2-(3-methylbutylamino)-2-oxoethyl] ester IUPAC Name: [2-(3-methylbutylamino)-2-oxoethyl] 4-[(propan-2-ylcarbamoylamino)methyl]benzoate Traditional Name: 4-[(isopropylcarbamoylamino)methyl]benzoic acid [2-(isoamylamino)-2-keto-ethyl] ester Formula: C19H29N3O4 MolecularWeight: 363.45126

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C19H29N3O4/c1-13(2)9-10-20-17(23)12-26-18(24)16-7-5-15(6-8-16)11-21-19(25)22-14(3)4/h5-8,13-14H,9-12H2,1-4H3,(H,20,23)(H2,21,22,25)