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

Systemtic Name: dodecyl 2-[3-oxidanylidene-1-(4-phenylphenyl)carbonyl-piperazin-2-yl]ethanoate Openeye Name: dodecyl 2-[3-oxo-1-(4-phenylbenzoyl)piperazin-2-yl]acetate CAS Name: 2-[3-oxo-1-[oxo-(4-phenylphenyl)methyl]-2-piperazinyl]acetic acid dodecyl ester IUPAC Name: dodecyl 2-[3-oxo-1-(4-phenylbenzoyl)piperazin-2-yl]acetate Traditional Name: 2-[3-keto-1-(4-phenylbenzoyl)piperazin-2-yl]acetic acid lauryl ester Formula: C31H42N2O4 MolecularWeight: 506.67618

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C31H42N2O4/c1-2-3-4-5-6-7-8-9-10-14-23-37-29(34)24-28-30(35)32-21-22-33(28)31(36)27-19-17-26(18-20-27)25-15-12-11-13-16-25/h11-13,15-20,28H,2-10,14,21-24H2,1H3,(H,32,35)