tert-butyl 4-[(2R)-2-[(4-ethoxyphenyl)carbonylamino]-3-methyl-butanoyl]piperazine-1-carboxylate

Systemtic Name: tert-butyl 4-[(2R)-2-[(4-ethoxyphenyl)carbonylamino]-3-methyl-butanoyl]piperazine-1-carboxylate Openeye Name: tert-butyl 4-[(2R)-2-[(4-ethoxybenzoyl)amino]-3-methyl-butanoyl]piperazine-1-carboxylate CAS Name: 4-[(2R)-2-[[(4-ethoxyphenyl)-oxomethyl]amino]-3-methyl-1-oxobutyl]-1-piperazinecarboxylic acid tert-butyl ester IUPAC Name: tert-butyl 4-[(2R)-2-[(4-ethoxybenzoyl)amino]-3-methylbutanoyl]piperazine-1-carboxylate Traditional Name: 4-[(2R)-2-[(4-ethoxybenzoyl)amino]-3-methyl-butanoyl]piperazine-1-carboxylic acid tert-butyl ester Formula: C23H35N3O5 MolecularWeight: 433.5411

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=CC=C(C=C1)C(=O)NC(C(C)C)C(=O)N2CCN(CC2)C(=O)OC(C)(C)C

Isomeric SMILES

CCOC1=CC=C(C=C1)C(=O)N[C@H](C(C)C)C(=O)N2CCN(CC2)C(=O)OC(C)(C)C

InChI

InChI=1S/C23H35N3O5/c1-7-30-18-10-8-17(9-11-18)20(27)24-19(16(2)3)21(28)25-12-14-26(15-13-25)22(29)31-23(4,5)6/h8-11,16,19H,7,12-15H2,1-6H3,(H,24,27)/t19-/m1/s1