diethyl-[(2S)-4-methyl-1-[(2-nitrophenyl)carbamoylamino]pentan-2-yl]azanium

Systemtic Name: diethyl-[(2S)-4-methyl-1-[(2-nitrophenyl)carbamoylamino]pentan-2-yl]azanium Openeye Name: diethyl-[(1S)-3-methyl-1-[[(2-nitrophenyl)carbamoylamino]methyl]butyl]ammonium CAS Name: diethyl-[(2S)-4-methyl-1-[[(2-nitroanilino)-oxomethyl]amino]pentan-2-yl]ammonium IUPAC Name: diethyl-[(2S)-4-methyl-1-[(2-nitrophenyl)carbamoylamino]pentan-2-yl]azanium Traditional Name: diethyl-[(1S)-3-methyl-1-[[(2-nitrophenyl)carbamoylamino]methyl]butyl]ammonium Formula: C17H29N4O3+ MolecularWeight: 337.43716

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Descriptors Computed from Structure

Canonical SMILES:

CC[NH+](CC)C(CC(C)C)CNC(=O)NC1=CC=CC=C1[N+](=O)[O-]

Isomeric SMILES

CC[NH+](CC)[C@@H](CC(C)C)CNC(=O)NC1=CC=CC=C1[N+](=O)[O-]

InChI

InChI=1S/C17H28N4O3/c1-5-20(6-2)14(11-13(3)4)12-18-17(22)19-15-9-7-8-10-16(15)21(23)24/h7-10,13-14H,5-6,11-12H2,1-4H3,(H2,18,19,22)/p+1/t14-/m0/s1