(3R)-3-cyclohexyl-3-(5-nitro-1H-indol-3-yl)propanoic acid

Systemtic Name: (3R)-3-cyclohexyl-3-(5-nitro-1H-indol-3-yl)propanoic acid Openeye Name: (3R)-3-cyclohexyl-3-(5-nitro-1H-indol-3-yl)propanoic acid CAS Name: (3R)-3-cyclohexyl-3-(5-nitro-1H-indol-3-yl)propanoic acid IUPAC Name: (3R)-3-cyclohexyl-3-(5-nitro-1H-indol-3-yl)propanoic acid Traditional Name: (3R)-3-cyclohexyl-3-(5-nitro-1H-indol-3-yl)propionic acid Formula: C17H20N2O4 MolecularWeight: 316.3517

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC(CC1)C(CC(=O)O)C2=CNC3=C2C=C(C=C3)[N+](=O)[O-]

Isomeric SMILES

C1CCC(CC1)[C@@H](CC(=O)O)C2=CNC3=C2C=C(C=C3)[N+](=O)[O-]

InChI

InChI=1S/C17H20N2O4/c20-17(21)9-13(11-4-2-1-3-5-11)15-10-18-16-7-6-12(19(22)23)8-14(15)16/h6-8,10-11,13,18H,1-5,9H2,(H,20,21)/t13-/m1/s1