2-[[[(2R)-1-(1H-imidazol-5-yl)propan-2-yl]amino]-oxidanyl-phenyl-methyl]-3-nitro-phenol

Systemtic Name: 2-[[[(2R)-1-(1H-imidazol-5-yl)propan-2-yl]amino]-oxidanyl-phenyl-methyl]-3-nitro-phenol Openeye Name: 2-[hydroxy-[[(1R)-2-(1H-imidazol-5-yl)-1-methyl-ethyl]amino]-phenyl-methyl]-3-nitro-phenol CAS Name: 2-[hydroxy-[[(2R)-1-(1H-imidazol-5-yl)propan-2-yl]amino]-phenylmethyl]-3-nitrophenol IUPAC Name: 2-[hydroxy-[[(2R)-1-(1H-imidazol-5-yl)propan-2-yl]amino]-phenylmethyl]-3-nitrophenol Traditional Name: 2-[hydroxy-[[(1R)-2-(1H-imidazol-5-yl)-1-methyl-ethyl]amino]-phenyl-methyl]-3-nitro-phenol Formula: C19H20N4O4 MolecularWeight: 368.3865

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Descriptors Computed from Structure

Canonical SMILES:

CC(CC1=CN=CN1)NC(C2=CC=CC=C2)(C3=C(C=CC=C3O)[N+](=O)[O-])O

Isomeric SMILES

C[C@H](CC1=CN=CN1)NC(C2=CC=CC=C2)(C3=C(C=CC=C3O)[N+](=O)[O-])O

InChI

InChI=1S/C19H20N4O4/c1-13(10-15-11-20-12-21-15)22-19(25,14-6-3-2-4-7-14)18-16(23(26)27)8-5-9-17(18)24/h2-9,11-13,22,24-25H,10H2,1H3,(H,20,21)/t13-,19?/m1/s1