(2-nitrophenyl)methyl-[(4S)-4,5,6,7-tetrahydro-1-benzofuran-4-yl]azanium

Systemtic Name: (2-nitrophenyl)methyl-[(4S)-4,5,6,7-tetrahydro-1-benzofuran-4-yl]azanium Openeye Name: (2-nitrophenyl)methyl-[(4S)-4,5,6,7-tetrahydrobenzofuran-4-yl]ammonium CAS Name: (2-nitrophenyl)methyl-[(4S)-4,5,6,7-tetrahydrobenzofuran-4-yl]ammonium IUPAC Name: (2-nitrophenyl)methyl-[(4S)-4,5,6,7-tetrahydro-1-benzofuran-4-yl]azanium Traditional Name: (2-nitrobenzyl)-[(4S)-4,5,6,7-tetrahydrobenzofuran-4-yl]ammonium Formula: C15H17N2O3+ MolecularWeight: 273.30708

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1CC(C2=C(C1)OC=C2)[NH2+]CC3=CC=CC=C3[N+](=O)[O-]

Isomeric SMILES

C1C[C@@H](C2=C(C1)OC=C2)[NH2+]CC3=CC=CC=C3[N+](=O)[O-]

InChI

InChI=1S/C15H16N2O3/c18-17(19)14-6-2-1-4-11(14)10-16-13-5-3-7-15-12(13)8-9-20-15/h1-2,4,6,8-9,13,16H,3,5,7,10H2/p+1/t13-/m0/s1