2-piperidin-4-ylethanoyl 2-[2-(1,3-benzoxazol-6-yl)-2-[(2-methylphenyl)amino]ethanoyl]pyrrolidine-1-carboxylate

Systemtic Name: 2-piperidin-4-ylethanoyl 2-[2-(1,3-benzoxazol-6-yl)-2-[(2-methylphenyl)amino]ethanoyl]pyrrolidine-1-carboxylate Openeye Name: [2-(4-piperidyl)acetyl] 2-[2-(1,3-benzoxazol-6-yl)-2-(2-methylanilino)acetyl]pyrrolidine-1-carboxylate CAS Name: 2-[2-(1,3-benzoxazol-6-yl)-2-(2-methylanilino)-1-oxoethyl]-1-pyrrolidinecarboxylic acid [1-oxo-2-(4-piperidinyl)ethyl] ester IUPAC Name: (2-piperidin-4-ylacetyl) 2-[2-(1,3-benzoxazol-6-yl)-2-(2-methylanilino)acetyl]pyrrolidine-1-carboxylate Traditional Name: 2-[2-(1,3-benzoxazol-6-yl)-2-(o-toluidino)acetyl]pyrrolidine-1-carboxylic acid [2-(4-piperidyl)acetyl] ester Formula: C28H32N4O5 MolecularWeight: 504.57748

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC=C1NC(C2=CC3=C(C=C2)N=CO3)C(=O)C4CCCN4C(=O)OC(=O)CC5CCNCC5

Isomeric SMILES

CC1=CC=CC=C1NC(C2=CC3=C(C=C2)N=CO3)C(=O)C4CCCN4C(=O)OC(=O)CC5CCNCC5

InChI

InChI=1S/C28H32N4O5/c1-18-5-2-3-6-21(18)31-26(20-8-9-22-24(16-20)36-17-30-22)27(34)23-7-4-14-32(23)28(35)37-25(33)15-19-10-12-29-13-11-19/h2-3,5-6,8-9,16-17,19,23,26,29,31H,4,7,10-15H2,1H3