(2S)-2-[4-(2-nitrophenyl)piperazin-1-yl]-N-prop-2-enyl-propanamide

Systemtic Name: (2S)-2-[4-(2-nitrophenyl)piperazin-1-yl]-N-prop-2-enyl-propanamide Openeye Name: (2S)-N-allyl-2-[4-(2-nitrophenyl)piperazin-1-yl]propanamide CAS Name: (2S)-2-[4-(2-nitrophenyl)-1-piperazinyl]-N-prop-2-enylpropanamide IUPAC Name: (2S)-2-[4-(2-nitrophenyl)piperazin-1-yl]-N-prop-2-enylpropanamide Traditional Name: (2S)-N-allyl-2-[4-(2-nitrophenyl)piperazino]propionamide Formula: C16H22N4O3 MolecularWeight: 318.37088

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)NCC=C)N1CCN(CC1)C2=CC=CC=C2[N+](=O)[O-]

Isomeric SMILES

C[C@@H](C(=O)NCC=C)N1CCN(CC1)C2=CC=CC=C2[N+](=O)[O-]

InChI

InChI=1S/C16H22N4O3/c1-3-8-17-16(21)13(2)18-9-11-19(12-10-18)14-6-4-5-7-15(14)20(22)23/h3-7,13H,1,8-12H2,2H3,(H,17,21)/t13-/m0/s1