methyl (1R)-3-azanyl-1-(4-bromophenyl)-1H-benzo[f]chromene-2-carboxylate

Systemtic Name: methyl (1R)-3-azanyl-1-(4-bromophenyl)-1H-benzo[f]chromene-2-carboxylate Openeye Name: methyl (1R)-3-amino-1-(4-bromophenyl)-1H-benzo[f]chromene-2-carboxylate CAS Name: (1R)-3-amino-1-(4-bromophenyl)-1H-benzo[f][1]benzopyran-2-carboxylic acid methyl ester IUPAC Name: methyl (1R)-3-amino-1-(4-bromophenyl)-1H-benzo[f]chromene-2-carboxylate Traditional Name: (1R)-3-amino-1-(4-bromophenyl)-1H-benzo[f]chromene-2-carboxylic acid methyl ester Formula: C21H16BrNO3 MolecularWeight: 410.26064

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1=C(OC2=C(C1C3=CC=C(C=C3)Br)C4=CC=CC=C4C=C2)N

Isomeric SMILES

COC(=O)C1=C(OC2=C([C@H]1C3=CC=C(C=C3)Br)C4=CC=CC=C4C=C2)N

InChI

InChI=1S/C21H16BrNO3/c1-25-21(24)19-17(13-6-9-14(22)10-7-13)18-15-5-3-2-4-12(15)8-11-16(18)26-20(19)23/h2-11,17H,23H2,1H3/t17-/m1/s1