N-(4-methyl-2-nitro-phenyl)-2-[4-[2-oxidanylidene-2-(prop-2-enylamino)ethyl]piperazin-1-yl]-2-phenyl-ethanamide

Systemtic Name: N-(4-methyl-2-nitro-phenyl)-2-[4-[2-oxidanylidene-2-(prop-2-enylamino)ethyl]piperazin-1-yl]-2-phenyl-ethanamide Openeye Name: 2-[4-[2-(allylamino)-2-oxo-ethyl]piperazin-1-yl]-N-(4-methyl-2-nitro-phenyl)-2-phenyl-acetamide CAS Name: N-(4-methyl-2-nitrophenyl)-2-[4-[2-oxo-2-(prop-2-enylamino)ethyl]-1-piperazinyl]-2-phenylacetamide IUPAC Name: N-(4-methyl-2-nitrophenyl)-2-[4-[2-oxo-2-(prop-2-enylamino)ethyl]piperazin-1-yl]-2-phenylacetamide Traditional Name: 2-[4-[2-(allylamino)-2-keto-ethyl]piperazino]-N-(4-methyl-2-nitro-phenyl)-2-phenyl-acetamide Formula: C24H29N5O4 MolecularWeight: 451.51816

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1)NC(=O)C(C2=CC=CC=C2)N3CCN(CC3)CC(=O)NCC=C)[N+](=O)[O-]

Isomeric SMILES

CC1=CC(=C(C=C1)NC(=O)C(C2=CC=CC=C2)N3CCN(CC3)CC(=O)NCC=C)[N+](=O)[O-]

InChI

InChI=1S/C24H29N5O4/c1-3-11-25-22(30)17-27-12-14-28(15-13-27)23(19-7-5-4-6-8-19)24(31)26-20-10-9-18(2)16-21(20)29(32)33/h3-10,16,23H,1,11-15,17H2,2H3,(H,25,30)(H,26,31)