[(4aS)-7-nitro-1,2,3,4-tetrahydroxanthen-4a-yl]-ethyl-azanium

Systemtic Name: [(4aS)-7-nitro-1,2,3,4-tetrahydroxanthen-4a-yl]-ethyl-azanium Openeye Name: [(4aS)-7-nitro-1,2,3,4-tetrahydroxanthen-4a-yl]-ethyl-ammonium CAS Name: [(4aS)-7-nitro-1,2,3,4-tetrahydroxanthen-4a-yl]-ethylammonium IUPAC Name: [(4aS)-7-nitro-1,2,3,4-tetrahydroxanthen-4a-yl]-ethylazanium Traditional Name: [(4aS)-7-nitro-1,2,3,4-tetrahydroxanthen-4a-yl]-ethyl-ammonium Formula: C15H19N2O3+ MolecularWeight: 275.32296

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Descriptors Computed from Structure

Canonical SMILES:

CC[NH2+]C12CCCCC1=CC3=C(O2)C=CC(=C3)[N+](=O)[O-]

Isomeric SMILES

CC[NH2+][C@]12CCCCC1=CC3=C(O2)C=CC(=C3)[N+](=O)[O-]

InChI

InChI=1S/C15H18N2O3/c1-2-16-15-8-4-3-5-12(15)9-11-10-13(17(18)19)6-7-14(11)20-15/h6-7,9-10,16H,2-5,8H2,1H3/p+1/t15-/m0/s1