methyl 4-[[[2-(3,4-dihydro-1H-isoquinolin-2-ylmethyl)-1,3-oxazol-4-yl]carbonylamino]methyl]benzoate

Systemtic Name: methyl 4-[[[2-(3,4-dihydro-1H-isoquinolin-2-ylmethyl)-1,3-oxazol-4-yl]carbonylamino]methyl]benzoate Openeye Name: methyl 4-[[[2-(3,4-dihydro-1H-isoquinolin-2-ylmethyl)oxazole-4-carbonyl]amino]methyl]benzoate CAS Name: 4-[[[[2-(3,4-dihydro-1H-isoquinolin-2-ylmethyl)-4-oxazolyl]-oxomethyl]amino]methyl]benzoic acid methyl ester IUPAC Name: methyl 4-[[[2-(3,4-dihydro-1H-isoquinolin-2-ylmethyl)-1,3-oxazole-4-carbonyl]amino]methyl]benzoate Traditional Name: 4-[[[2-(3,4-dihydro-1H-isoquinolin-2-ylmethyl)oxazole-4-carbonyl]amino]methyl]benzoic acid methyl ester Formula: C23H23N3O4 MolecularWeight: 405.44642

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1=CC=C(C=C1)CNC(=O)C2=COC(=N2)CN3CCC4=CC=CC=C4C3

Isomeric SMILES

COC(=O)C1=CC=C(C=C1)CNC(=O)C2=COC(=N2)CN3CCC4=CC=CC=C4C3

InChI

InChI=1S/C23H23N3O4/c1-29-23(28)18-8-6-16(7-9-18)12-24-22(27)20-15-30-21(25-20)14-26-11-10-17-4-2-3-5-19(17)13-26/h2-9,15H,10-14H2,1H3,(H,24,27)