[(2S)-6-[(2-methylpropan-2-yl)oxycarbonylamino]-1-[(4-nitrophenyl)amino]-1-oxidanylidene-hexan-2-yl]azanium

Systemtic Name: [(2S)-6-[(2-methylpropan-2-yl)oxycarbonylamino]-1-[(4-nitrophenyl)amino]-1-oxidanylidene-hexan-2-yl]azanium Openeye Name: [(1S)-5-(tert-butoxycarbonylamino)-1-[(4-nitrophenyl)carbamoyl]pentyl]ammonium CAS Name: [(2S)-6-[[(2-methylpropan-2-yl)oxy-oxomethyl]amino]-1-(4-nitroanilino)-1-oxohexan-2-yl]ammonium IUPAC Name: [(2S)-6-[(2-methylpropan-2-yl)oxycarbonylamino]-1-(4-nitroanilino)-1-oxohexan-2-yl]azanium Traditional Name: [(1S)-5-(tert-butoxycarbonylamino)-1-[(4-nitrophenyl)carbamoyl]pentyl]ammonium Formula: C17H27N4O5+ MolecularWeight: 367.42008

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)OC(=O)NCCCCC(C(=O)NC1=CC=C(C=C1)[N+](=O)[O-])[NH3+]

Isomeric SMILES

CC(C)(C)OC(=O)NCCCC[C@@H](C(=O)NC1=CC=C(C=C1)[N+](=O)[O-])[NH3+]

InChI

InChI=1S/C17H26N4O5/c1-17(2,3)26-16(23)19-11-5-4-6-14(18)15(22)20-12-7-9-13(10-8-12)21(24)25/h7-10,14H,4-6,11,18H2,1-3H3,(H,19,23)(H,20,22)/p+1/t14-/m0/s1