2-azanyl-4-(3-bromophenyl)-3-cyano-4H-chromen-7-olate; morpholin-4-ium

Systemtic Name: 2-azanyl-4-(3-bromophenyl)-3-cyano-4H-chromen-7-olate; morpholin-4-ium Openeye Name: 2-amino-4-(3-bromophenyl)-3-cyano-4H-chromen-7-olate; morpholin-4-ium CAS Name: 2-amino-4-(3-bromophenyl)-3-cyano-4H-1-benzopyran-7-olate; morpholin-4-ium IUPAC Name: 2-amino-4-(3-bromophenyl)-3-cyano-4H-chromen-7-olate; morpholin-4-ium Traditional Name: 2-amino-4-(3-bromophenyl)-3-cyano-4H-chromen-7-olate; morpholin-4-ium Formula: C20H20BrN3O3 MolecularWeight: 430.2951

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Descriptors Computed from Structure

Canonical SMILES:

C1COCC[NH2+]1.C1=CC(=CC(=C1)Br)C2C3=C(C=C(C=C3)[O-])OC(=C2C#N)N

Isomeric SMILES

C1COCC[NH2+]1.C1=CC(=CC(=C1)Br)C2C3=C(C=C(C=C3)[O-])OC(=C2C#N)N

InChI

InChI=1S/C16H11BrN2O2.C4H9NO/c17-10-3-1-2-9(6-10)15-12-5-4-11(20)7-14(12)21-16(19)13(15)8-18;1-3-6-4-2-5-1/h1-7,15,20H,19H2;5H,1-4H2