(3-aminocarbonyl-8-methoxy-chromen-2-ylidene)-[(4-bromophenyl)carbonylamino]azanium

Systemtic Name: (3-aminocarbonyl-8-methoxy-chromen-2-ylidene)-[(4-bromophenyl)carbonylamino]azanium Openeye Name: [(4-bromobenzoyl)amino]-(3-carbamoyl-8-methoxy-chromen-2-ylidene)ammonium CAS Name: [[(4-bromophenyl)-oxomethyl]amino]-(3-carbamoyl-8-methoxy-1-benzopyran-2-ylidene)ammonium IUPAC Name: [(4-bromobenzoyl)amino]-(3-carbamoyl-8-methoxychromen-2-ylidene)azanium Traditional Name: [(4-bromobenzoyl)amino]-(3-carbamoyl-8-methoxy-chromen-2-ylidene)ammonium Formula: C18H15BrN3O4+ MolecularWeight: 417.2334

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=CC2=C1OC(=[NH+]NC(=O)C3=CC=C(C=C3)Br)C(=C2)C(=O)N

Isomeric SMILES

COC1=CC=CC2=C1OC(=[NH+]NC(=O)C3=CC=C(C=C3)Br)C(=C2)C(=O)N

InChI

InChI=1S/C18H14BrN3O4/c1-25-14-4-2-3-11-9-13(16(20)23)18(26-15(11)14)22-21-17(24)10-5-7-12(19)8-6-10/h2-9H,1H3,(H2,20,23)(H,21,24)/p+1