ethyl 4-[(2S)-2-[(4-tert-butylphenyl)carbonylamino]-3-methyl-butanoyl]piperazine-1-carboxylate

Systemtic Name: ethyl 4-[(2S)-2-[(4-tert-butylphenyl)carbonylamino]-3-methyl-butanoyl]piperazine-1-carboxylate Openeye Name: ethyl 4-[(2S)-2-[(4-tert-butylbenzoyl)amino]-3-methyl-butanoyl]piperazine-1-carboxylate CAS Name: 4-[(2S)-2-[[(4-tert-butylphenyl)-oxomethyl]amino]-3-methyl-1-oxobutyl]-1-piperazinecarboxylic acid ethyl ester IUPAC Name: ethyl 4-[(2S)-2-[(4-tert-butylbenzoyl)amino]-3-methylbutanoyl]piperazine-1-carboxylate Traditional Name: 4-[(2S)-2-[(4-tert-butylbenzoyl)amino]-3-methyl-butanoyl]piperazine-1-carboxylic acid ethyl ester Formula: C23H35N3O4 MolecularWeight: 417.5417

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)N1CCN(CC1)C(=O)C(C(C)C)NC(=O)C2=CC=C(C=C2)C(C)(C)C

Isomeric SMILES

CCOC(=O)N1CCN(CC1)C(=O)[C@H](C(C)C)NC(=O)C2=CC=C(C=C2)C(C)(C)C

InChI

InChI=1S/C23H35N3O4/c1-7-30-22(29)26-14-12-25(13-15-26)21(28)19(16(2)3)24-20(27)17-8-10-18(11-9-17)23(4,5)6/h8-11,16,19H,7,12-15H2,1-6H3,(H,24,27)/t19-/m0/s1