methyl 4-[5-methyl-4-[[(5-oxidanylidenepyrrolidin-2-yl)methyl-propan-2-yl-amino]methyl]-1,3-oxazol-2-yl]benzoate

Systemtic Name: methyl 4-[5-methyl-4-[[(5-oxidanylidenepyrrolidin-2-yl)methyl-propan-2-yl-amino]methyl]-1,3-oxazol-2-yl]benzoate Openeye Name: methyl 4-[4-[[isopropyl-[(5-oxopyrrolidin-2-yl)methyl]amino]methyl]-5-methyl-oxazol-2-yl]benzoate CAS Name: 4-[5-methyl-4-[[(5-oxo-2-pyrrolidinyl)methyl-propan-2-ylamino]methyl]-2-oxazolyl]benzoic acid methyl ester IUPAC Name: methyl 4-[5-methyl-4-[[(5-oxopyrrolidin-2-yl)methyl-propan-2-ylamino]methyl]-1,3-oxazol-2-yl]benzoate Traditional Name: 4-[4-[[isopropyl-[(5-ketopyrrolidin-2-yl)methyl]amino]methyl]-5-methyl-oxazol-2-yl]benzoic acid methyl ester Formula: C21H27N3O4 MolecularWeight: 385.45678

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(N=C(O1)C2=CC=C(C=C2)C(=O)OC)CN(CC3CCC(=O)N3)C(C)C

Isomeric SMILES

CC1=C(N=C(O1)C2=CC=C(C=C2)C(=O)OC)CN(CC3CCC(=O)N3)C(C)C

InChI

InChI=1S/C21H27N3O4/c1-13(2)24(11-17-9-10-19(25)22-17)12-18-14(3)28-20(23-18)15-5-7-16(8-6-15)21(26)27-4/h5-8,13,17H,9-12H2,1-4H3,(H,22,25)