methyl (4R)-2-azanyl-4-(3-nitrophenyl)-4H-benzo[h]chromene-3-carboxylate

Systemtic Name: methyl (4R)-2-azanyl-4-(3-nitrophenyl)-4H-benzo[h]chromene-3-carboxylate Openeye Name: methyl (4R)-2-amino-4-(3-nitrophenyl)-4H-benzo[h]chromene-3-carboxylate CAS Name: (4R)-2-amino-4-(3-nitrophenyl)-4H-benzo[h][1]benzopyran-3-carboxylic acid methyl ester IUPAC Name: methyl (4R)-2-amino-4-(3-nitrophenyl)-4H-benzo[h]chromene-3-carboxylate Traditional Name: (4R)-2-amino-4-(3-nitrophenyl)-4H-benzo[h]chromene-3-carboxylic acid methyl ester Formula: C21H16N2O5 MolecularWeight: 376.36214

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1=C(OC2=C(C1C3=CC(=CC=C3)[N+](=O)[O-])C=CC4=CC=CC=C42)N

Isomeric SMILES

COC(=O)C1=C(OC2=C([C@H]1C3=CC(=CC=C3)[N+](=O)[O-])C=CC4=CC=CC=C42)N

InChI

InChI=1S/C21H16N2O5/c1-27-21(24)18-17(13-6-4-7-14(11-13)23(25)26)16-10-9-12-5-2-3-8-15(12)19(16)28-20(18)22/h2-11,17H,22H2,1H3/t17-/m1/s1