7-chloranyl-2-methoxy-4-oxidanidyl-5-phenyl-3H-1,4-benzodiazepin-4-ium

Systemtic Name: 7-chloranyl-2-methoxy-4-oxidanidyl-5-phenyl-3H-1,4-benzodiazepin-4-ium Openeye Name: 7-chloro-2-methoxy-4-oxido-5-phenyl-3H-1,4-benzodiazepin-4-ium CAS Name: 7-chloro-2-methoxy-4-oxido-5-phenyl-3H-1,4-benzodiazepin-4-ium IUPAC Name: 7-chloro-2-methoxy-4-oxido-5-phenyl-3H-1,4-benzodiazepin-4-ium Traditional Name: 7-chloro-2-methoxy-4-oxido-5-phenyl-3H-1,4-benzodiazepin-4-ium Formula: C16H13ClN2O2 MolecularWeight: 300.73962

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Descriptors Computed from Structure

Canonical SMILES:

COC1=NC2=C(C=C(C=C2)Cl)C(=[N+](C1)[O-])C3=CC=CC=C3

Isomeric SMILES

COC1=NC2=C(C=C(C=C2)Cl)C(=[N+](C1)[O-])C3=CC=CC=C3

InChI

InChI=1S/C16H13ClN2O2/c1-21-15-10-19(20)16(11-5-3-2-4-6-11)13-9-12(17)7-8-14(13)18-15/h2-9H,10H2,1H3