(4S)-2-azanyl-4-(3-bromophenyl)-5,7-bis(oxidanyl)-4H-chromene-3-carbonitrile

Systemtic Name: (4S)-2-azanyl-4-(3-bromophenyl)-5,7-bis(oxidanyl)-4H-chromene-3-carbonitrile Openeye Name: (4S)-2-amino-4-(3-bromophenyl)-5,7-dihydroxy-4H-chromene-3-carbonitrile CAS Name: (4S)-2-amino-4-(3-bromophenyl)-5,7-dihydroxy-4H-1-benzopyran-3-carbonitrile IUPAC Name: (4S)-2-amino-4-(3-bromophenyl)-5,7-dihydroxy-4H-chromene-3-carbonitrile Traditional Name: (4S)-2-amino-4-(3-bromophenyl)-5,7-dihydroxy-4H-chromene-3-carbonitrile Formula: C16H11BrN2O3 MolecularWeight: 359.17414

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC(=C1)Br)C2C(=C(OC3=CC(=CC(=C23)O)O)N)C#N

Isomeric SMILES

C1=CC(=CC(=C1)Br)[C@@H]2C(=C(OC3=CC(=CC(=C23)O)O)N)C#N

InChI

InChI=1S/C16H11BrN2O3/c17-9-3-1-2-8(4-9)14-11(7-18)16(19)22-13-6-10(20)5-12(21)15(13)14/h1-6,14,20-21H,19H2/t14-/m1/s1