ethyl 4-[[(3S)-3-methyl-5-oxidanylidene-5-[(4-propan-2-ylphenyl)amino]pentanoyl]amino]piperidine-1-carboxylate

Systemtic Name: ethyl 4-[[(3S)-3-methyl-5-oxidanylidene-5-[(4-propan-2-ylphenyl)amino]pentanoyl]amino]piperidine-1-carboxylate Openeye Name: ethyl 4-[[(3S)-5-(4-isopropylanilino)-3-methyl-5-oxo-pentanoyl]amino]piperidine-1-carboxylate CAS Name: 4-[[(3S)-3-methyl-1,5-dioxo-5-(4-propan-2-ylanilino)pentyl]amino]-1-piperidinecarboxylic acid ethyl ester IUPAC Name: ethyl 4-[[(3S)-3-methyl-5-oxo-5-(4-propan-2-ylanilino)pentanoyl]amino]piperidine-1-carboxylate Traditional Name: 4-[[(3S)-5-cumidino-5-keto-3-methyl-pentanoyl]amino]piperidine-1-carboxylic acid ethyl ester Formula: C23H35N3O4 MolecularWeight: 417.5417

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)N1CCC(CC1)NC(=O)CC(C)CC(=O)NC2=CC=C(C=C2)C(C)C

Isomeric SMILES

CCOC(=O)N1CCC(CC1)NC(=O)C[C@H](C)CC(=O)NC2=CC=C(C=C2)C(C)C

InChI

InChI=1S/C23H35N3O4/c1-5-30-23(29)26-12-10-20(11-13-26)25-22(28)15-17(4)14-21(27)24-19-8-6-18(7-9-19)16(2)3/h6-9,16-17,20H,5,10-15H2,1-4H3,(H,24,27)(H,25,28)/t17-/m1/s1