3-[(2S,3S,4R)-2-(4-methoxyphenyl)-3-nitro-3,4-dihydro-2H-chromen-4-yl]-2-methyl-1H-indole

Systemtic Name: 3-[(2S,3S,4R)-2-(4-methoxyphenyl)-3-nitro-3,4-dihydro-2H-chromen-4-yl]-2-methyl-1H-indole Openeye Name: 3-[(2S,3S,4R)-2-(4-methoxyphenyl)-3-nitro-chroman-4-yl]-2-methyl-1H-indole CAS Name: 3-[(2S,3S,4R)-2-(4-methoxyphenyl)-3-nitro-3,4-dihydro-2H-1-benzopyran-4-yl]-2-methyl-1H-indole IUPAC Name: 3-[(2S,3S,4R)-2-(4-methoxyphenyl)-3-nitro-3,4-dihydro-2H-chromen-4-yl]-2-methyl-1H-indole Traditional Name: 3-[(2S,3S,4R)-2-(4-methoxyphenyl)-3-nitro-chroman-4-yl]-2-methyl-1H-indole Formula: C25H22N2O4 MolecularWeight: 414.45318

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C2=CC=CC=C2N1)C3C(C(OC4=CC=CC=C34)C5=CC=C(C=C5)OC)[N+](=O)[O-]

Isomeric SMILES

CC1=C(C2=CC=CC=C2N1)[C@H]3[C@@H]([C@@H](OC4=CC=CC=C34)C5=CC=C(C=C5)OC)[N+](=O)[O-]

InChI

InChI=1S/C25H22N2O4/c1-15-22(18-7-3-5-9-20(18)26-15)23-19-8-4-6-10-21(19)31-25(24(23)27(28)29)16-11-13-17(30-2)14-12-16/h3-14,23-26H,1-2H3/t23-,24-,25-/m0/s1