3-(3-nitrophenyl)-1-oxidanidyl-1-[(2S)-4-(oxidanylamino)pent-4-en-2-yl]urea

Systemtic Name: 3-(3-nitrophenyl)-1-oxidanidyl-1-[(2S)-4-(oxidanylamino)pent-4-en-2-yl]urea Openeye Name: 1-[(1S)-3-(hydroxyamino)-1-methyl-but-3-enyl]-3-(3-nitrophenyl)-1-oxido-urea CAS Name: 1-[(2S)-4-(hydroxyamino)pent-4-en-2-yl]-3-(3-nitrophenyl)-1-oxidourea IUPAC Name: 1-[(2S)-4-(hydroxyamino)pent-4-en-2-yl]-3-(3-nitrophenyl)-1-oxidourea Traditional Name: 1-[(1S)-3-(hydroxyamino)-1-methyl-but-3-enyl]-3-(3-nitrophenyl)-1-oxido-urea Formula: C12H15N4O5- MolecularWeight: 295.2713

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Descriptors Computed from Structure

Canonical SMILES:

CC(CC(=C)NO)N(C(=O)NC1=CC(=CC=C1)[N+](=O)[O-])[O-]

Isomeric SMILES

C[C@@H](CC(=C)NO)N(C(=O)NC1=CC(=CC=C1)[N+](=O)[O-])[O-]

InChI

InChI=1S/C12H15N4O5/c1-8(14-18)6-9(2)15(19)12(17)13-10-4-3-5-11(7-10)16(20)21/h3-5,7,9,14,18H,1,6H2,2H3,(H,13,17)/q-1/t9-/m0/s1