methyl 4-[[[1-(1,3-benzoxazol-2-yl)piperidin-4-yl]carbonyl-methyl-amino]methyl]benzoate

Systemtic Name: methyl 4-[[[1-(1,3-benzoxazol-2-yl)piperidin-4-yl]carbonyl-methyl-amino]methyl]benzoate Openeye Name: methyl 4-[[[1-(1,3-benzoxazol-2-yl)piperidine-4-carbonyl]-methyl-amino]methyl]benzoate CAS Name: 4-[[[[1-(1,3-benzoxazol-2-yl)-4-piperidinyl]-oxomethyl]-methylamino]methyl]benzoic acid methyl ester IUPAC Name: methyl 4-[[[1-(1,3-benzoxazol-2-yl)piperidine-4-carbonyl]-methylamino]methyl]benzoate Traditional Name: 4-[[[1-(1,3-benzoxazol-2-yl)isonipecotoyl]-methyl-amino]methyl]benzoic acid methyl ester Formula: C23H25N3O4 MolecularWeight: 407.4623

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Descriptors Computed from Structure

Canonical SMILES:

CN(CC1=CC=C(C=C1)C(=O)OC)C(=O)C2CCN(CC2)C3=NC4=CC=CC=C4O3

Isomeric SMILES

CN(CC1=CC=C(C=C1)C(=O)OC)C(=O)C2CCN(CC2)C3=NC4=CC=CC=C4O3

InChI

InChI=1S/C23H25N3O4/c1-25(15-16-7-9-18(10-8-16)22(28)29-2)21(27)17-11-13-26(14-12-17)23-24-19-5-3-4-6-20(19)30-23/h3-10,17H,11-15H2,1-2H3