[4-[[(1S,2R)-1-(4-hydroxyphenyl)-1-oxidanyl-propan-2-yl]amino]-3-nitro-phenyl]-phenyl-methanone

Systemtic Name: [4-[[(1S,2R)-1-(4-hydroxyphenyl)-1-oxidanyl-propan-2-yl]amino]-3-nitro-phenyl]-phenyl-methanone Openeye Name: [4-[[(1R,2S)-2-hydroxy-2-(4-hydroxyphenyl)-1-methyl-ethyl]amino]-3-nitro-phenyl]-phenyl-methanone CAS Name: [4-[[(1S,2R)-1-hydroxy-1-(4-hydroxyphenyl)propan-2-yl]amino]-3-nitrophenyl]-phenylmethanone IUPAC Name: [4-[[(1S,2R)-1-hydroxy-1-(4-hydroxyphenyl)propan-2-yl]amino]-3-nitrophenyl]-phenylmethanone Traditional Name: [4-[[(1R,2S)-2-hydroxy-2-(4-hydroxyphenyl)-1-methyl-ethyl]amino]-3-nitro-phenyl]-phenyl-methanone Formula: C22H20N2O5 MolecularWeight: 392.4046

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(C1=CC=C(C=C1)O)O)NC2=C(C=C(C=C2)C(=O)C3=CC=CC=C3)[N+](=O)[O-]

Isomeric SMILES

C[C@H]([C@H](C1=CC=C(C=C1)O)O)NC2=C(C=C(C=C2)C(=O)C3=CC=CC=C3)[N+](=O)[O-]

InChI

InChI=1S/C22H20N2O5/c1-14(21(26)16-7-10-18(25)11-8-16)23-19-12-9-17(13-20(19)24(28)29)22(27)15-5-3-2-4-6-15/h2-14,21,23,25-26H,1H3/t14-,21-/m1/s1