3-(2-nitro-1-phenyl-ethyl)-2-propan-2-yl-2,3-dihydrochromen-4-one

Systemtic Name: 3-(2-nitro-1-phenyl-ethyl)-2-propan-2-yl-2,3-dihydrochromen-4-one Openeye Name: 2-isopropyl-3-(2-nitro-1-phenyl-ethyl)chroman-4-one CAS Name: 3-(2-nitro-1-phenylethyl)-2-propan-2-yl-3,4-dihydro-2H-1-benzopyran-4-one IUPAC Name: 3-(2-nitro-1-phenylethyl)-2-propan-2-yl-2,3-dihydrochromen-4-one Traditional Name: 2-isopropyl-3-(2-nitro-1-phenyl-ethyl)chroman-4-one Formula: C20H21NO4 MolecularWeight: 339.38504

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C1C(C(=O)C2=CC=CC=C2O1)C(C[N+](=O)[O-])C3=CC=CC=C3

Isomeric SMILES

CC(C)C1C(C(=O)C2=CC=CC=C2O1)C(C[N+](=O)[O-])C3=CC=CC=C3

InChI

InChI=1S/C20H21NO4/c1-13(2)20-18(19(22)15-10-6-7-11-17(15)25-20)16(12-21(23)24)14-8-4-3-5-9-14/h3-11,13,16,18,20H,12H2,1-2H3