ethyl 4-[2-(3-methylbutanoylamino)phenyl]carbonylpiperazine-1-carboxylate

Systemtic Name: ethyl 4-[2-(3-methylbutanoylamino)phenyl]carbonylpiperazine-1-carboxylate Openeye Name: ethyl 4-[2-(3-methylbutanoylamino)benzoyl]piperazine-1-carboxylate CAS Name: 4-[[2-[(3-methyl-1-oxobutyl)amino]phenyl]-oxomethyl]-1-piperazinecarboxylic acid ethyl ester IUPAC Name: ethyl 4-[2-(3-methylbutanoylamino)benzoyl]piperazine-1-carboxylate Traditional Name: 4-[2-(isovalerylamino)benzoyl]piperazine-1-carboxylic acid ethyl ester Formula: C19H27N3O4 MolecularWeight: 361.43538

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)N1CCN(CC1)C(=O)C2=CC=CC=C2NC(=O)CC(C)C

Isomeric SMILES

CCOC(=O)N1CCN(CC1)C(=O)C2=CC=CC=C2NC(=O)CC(C)C

InChI

InChI=1S/C19H27N3O4/c1-4-26-19(25)22-11-9-21(10-12-22)18(24)15-7-5-6-8-16(15)20-17(23)13-14(2)3/h5-8,14H,4,9-13H2,1-3H3,(H,20,23)