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

Systemtic Name: dodecyl 2-[1-(3-nitrophenyl)carbonyl-3-oxidanylidene-piperazin-2-yl]ethanoate Openeye Name: dodecyl 2-[1-(3-nitrobenzoyl)-3-oxo-piperazin-2-yl]acetate CAS Name: 2-[1-[(3-nitrophenyl)-oxomethyl]-3-oxo-2-piperazinyl]acetic acid dodecyl ester IUPAC Name: dodecyl 2-[1-(3-nitrobenzoyl)-3-oxopiperazin-2-yl]acetate Traditional Name: 2-[3-keto-1-(3-nitrobenzoyl)piperazin-2-yl]acetic acid lauryl ester Formula: C25H37N3O6 MolecularWeight: 475.57778

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCOC(=O)CC1C(=O)NCCN1C(=O)C2=CC(=CC=C2)[N+](=O)[O-]

Isomeric SMILES

CCCCCCCCCCCCOC(=O)CC1C(=O)NCCN1C(=O)C2=CC(=CC=C2)[N+](=O)[O-]

InChI

InChI=1S/C25H37N3O6/c1-2-3-4-5-6-7-8-9-10-11-17-34-23(29)19-22-24(30)26-15-16-27(22)25(31)20-13-12-14-21(18-20)28(32)33/h12-14,18,22H,2-11,15-17,19H2,1H3,(H,26,30)