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

Systemtic Name: ethyl 4-[(2S)-2-[(4-methoxyphenyl)carbonylamino]-3-methyl-butanoyl]piperazine-1-carboxylate Openeye Name: ethyl 4-[(2S)-2-[(4-methoxybenzoyl)amino]-3-methyl-butanoyl]piperazine-1-carboxylate CAS Name: 4-[(2S)-2-[[(4-methoxyphenyl)-oxomethyl]amino]-3-methyl-1-oxobutyl]-1-piperazinecarboxylic acid ethyl ester IUPAC Name: ethyl 4-[(2S)-2-[(4-methoxybenzoyl)amino]-3-methylbutanoyl]piperazine-1-carboxylate Traditional Name: 4-[(2S)-3-methyl-2-(p-anisoylamino)butanoyl]piperazine-1-carboxylic acid ethyl ester Formula: C20H29N3O5 MolecularWeight: 391.46136

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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)OC

Isomeric SMILES

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

InChI

InChI=1S/C20H29N3O5/c1-5-28-20(26)23-12-10-22(11-13-23)19(25)17(14(2)3)21-18(24)15-6-8-16(27-4)9-7-15/h6-9,14,17H,5,10-13H2,1-4H3,(H,21,24)/t17-/m0/s1