ethyl 4-[2-[[4-[(2S)-butan-2-yl]phenyl]amino]-2-oxidanylidene-ethyl]piperazine-1-carboxylate

Systemtic Name: ethyl 4-[2-[[4-[(2S)-butan-2-yl]phenyl]amino]-2-oxidanylidene-ethyl]piperazine-1-carboxylate Openeye Name: ethyl 4-[2-[4-[(1S)-1-methylpropyl]anilino]-2-oxo-ethyl]piperazine-1-carboxylate CAS Name: 4-[2-[4-[(2S)-butan-2-yl]anilino]-2-oxoethyl]-1-piperazinecarboxylic acid ethyl ester IUPAC Name: ethyl 4-[2-[4-[(2S)-butan-2-yl]anilino]-2-oxoethyl]piperazine-1-carboxylate Traditional Name: 4-[2-keto-2-[4-[(1S)-1-methylpropyl]anilino]ethyl]piperazine-1-carboxylic acid ethyl ester Formula: C19H29N3O3 MolecularWeight: 347.45186

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C)C1=CC=C(C=C1)NC(=O)CN2CCN(CC2)C(=O)OCC

Isomeric SMILES

CC[C@H](C)C1=CC=C(C=C1)NC(=O)CN2CCN(CC2)C(=O)OCC

InChI

InChI=1S/C19H29N3O3/c1-4-15(3)16-6-8-17(9-7-16)20-18(23)14-21-10-12-22(13-11-21)19(24)25-5-2/h6-9,15H,4-5,10-14H2,1-3H3,(H,20,23)/t15-/m0/s1