tert-butyl 4-[2-(6-benzamido-1,2-benzoxazol-3-yl)ethyl]piperidine-1-carboxylate

Systemtic Name: tert-butyl 4-[2-(6-benzamido-1,2-benzoxazol-3-yl)ethyl]piperidine-1-carboxylate Openeye Name: tert-butyl 4-[2-(6-benzamido-1,2-benzoxazol-3-yl)ethyl]piperidine-1-carboxylate CAS Name: 4-[2-(6-benzamido-1,2-benzoxazol-3-yl)ethyl]-1-piperidinecarboxylic acid tert-butyl ester IUPAC Name: tert-butyl 4-[2-(6-benzamido-1,2-benzoxazol-3-yl)ethyl]piperidine-1-carboxylate Traditional Name: 4-[2-(6-benzamidoindoxazen-3-yl)ethyl]piperidine-1-carboxylic acid tert-butyl ester Formula: C26H31N3O4 MolecularWeight: 449.54204

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)OC(=O)N1CCC(CC1)CCC2=NOC3=C2C=CC(=C3)NC(=O)C4=CC=CC=C4

Isomeric SMILES

CC(C)(C)OC(=O)N1CCC(CC1)CCC2=NOC3=C2C=CC(=C3)NC(=O)C4=CC=CC=C4

InChI

InChI=1S/C26H31N3O4/c1-26(2,3)32-25(31)29-15-13-18(14-16-29)9-12-22-21-11-10-20(17-23(21)33-28-22)27-24(30)19-7-5-4-6-8-19/h4-8,10-11,17-18H,9,12-16H2,1-3H3,(H,27,30)