tert-butyl 2-[2-[(3-methylphenyl)carbamoylamino]ethanoyl-(2-piperidin-4-ylcarbonylphenyl)amino]ethanoate

Systemtic Name: tert-butyl 2-[2-[(3-methylphenyl)carbamoylamino]ethanoyl-(2-piperidin-4-ylcarbonylphenyl)amino]ethanoate Openeye Name: tert-butyl 2-[N-[2-(m-tolylcarbamoylamino)acetyl]-2-(piperidine-4-carbonyl)anilino]acetate CAS Name: 2-[N-[2-[[(3-methylanilino)-oxomethyl]amino]-1-oxoethyl]-2-[oxo(4-piperidinyl)methyl]anilino]acetic acid tert-butyl ester IUPAC Name: tert-butyl 2-[N-[2-[(3-methylphenyl)carbamoylamino]acetyl]-2-(piperidine-4-carbonyl)anilino]acetate Traditional Name: 2-(2-isonipecotoyl-N-[2-(m-tolylcarbamoylamino)acetyl]anilino)acetic acid tert-butyl ester Formula: C28H36N4O5 MolecularWeight: 508.60924

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC=C1)NC(=O)NCC(=O)N(CC(=O)OC(C)(C)C)C2=CC=CC=C2C(=O)C3CCNCC3

Isomeric SMILES

CC1=CC(=CC=C1)NC(=O)NCC(=O)N(CC(=O)OC(C)(C)C)C2=CC=CC=C2C(=O)C3CCNCC3

InChI

InChI=1S/C28H36N4O5/c1-19-8-7-9-21(16-19)31-27(36)30-17-24(33)32(18-25(34)37-28(2,3)4)23-11-6-5-10-22(23)26(35)20-12-14-29-15-13-20/h5-11,16,20,29H,12-15,17-18H2,1-4H3,(H2,30,31,36)