3-methylbutyl 2-[3-oxidanylidene-1-(4-phenylphenyl)carbonyl-piperazin-2-yl]ethanoate

Systemtic Name: 3-methylbutyl 2-[3-oxidanylidene-1-(4-phenylphenyl)carbonyl-piperazin-2-yl]ethanoate Openeye Name: isopentyl 2-[3-oxo-1-(4-phenylbenzoyl)piperazin-2-yl]acetate CAS Name: 2-[3-oxo-1-[oxo-(4-phenylphenyl)methyl]-2-piperazinyl]acetic acid 3-methylbutyl ester IUPAC Name: 3-methylbutyl 2-[3-oxo-1-(4-phenylbenzoyl)piperazin-2-yl]acetate Traditional Name: 2-[3-keto-1-(4-phenylbenzoyl)piperazin-2-yl]acetic acid isoamyl ester Formula: C24H28N2O4 MolecularWeight: 408.49012

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CCOC(=O)CC1C(=O)NCCN1C(=O)C2=CC=C(C=C2)C3=CC=CC=C3

Isomeric SMILES

CC(C)CCOC(=O)CC1C(=O)NCCN1C(=O)C2=CC=C(C=C2)C3=CC=CC=C3

InChI

InChI=1S/C24H28N2O4/c1-17(2)12-15-30-22(27)16-21-23(28)25-13-14-26(21)24(29)20-10-8-19(9-11-20)18-6-4-3-5-7-18/h3-11,17,21H,12-16H2,1-2H3,(H,25,28)