7-chloranyl-3-(3-ethylimidazol-3-ium-1-yl)-5-phenyl-1,3-dihydro-1,4-benzodiazepin-2-one

Systemtic Name: 7-chloranyl-3-(3-ethylimidazol-3-ium-1-yl)-5-phenyl-1,3-dihydro-1,4-benzodiazepin-2-one Openeye Name: 7-chloro-3-(3-ethylimidazol-3-ium-1-yl)-5-phenyl-1,3-dihydro-1,4-benzodiazepin-2-one CAS Name: 7-chloro-3-(3-ethyl-1-imidazol-3-iumyl)-5-phenyl-1,3-dihydro-1,4-benzodiazepin-2-one IUPAC Name: 7-chloro-3-(3-ethylimidazol-3-ium-1-yl)-5-phenyl-1,3-dihydro-1,4-benzodiazepin-2-one Traditional Name: 7-chloro-3-(3-ethylimidazol-3-ium-1-yl)-5-phenyl-1,3-dihydro-1,4-benzodiazepin-2-one Formula: C20H18ClN4O+ MolecularWeight: 365.83612

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Descriptors Computed from Structure

Canonical SMILES:

CC[N+]1=CN(C=C1)C2C(=O)NC3=C(C=C(C=C3)Cl)C(=N2)C4=CC=CC=C4

Isomeric SMILES

CC[N+]1=CN(C=C1)C2C(=O)NC3=C(C=C(C=C3)Cl)C(=N2)C4=CC=CC=C4

InChI

InChI=1S/C20H17ClN4O/c1-2-24-10-11-25(13-24)19-20(26)22-17-9-8-15(21)12-16(17)18(23-19)14-6-4-3-5-7-14/h3-13,19H,2H2,1H3/p+1