2-[3-[5-chloranyl-1-ethyl-3-(2-morpholin-4-ylethyl)benzimidazol-2-ylidene]prop-1-enyl]-3-ethyl-1,3-benzoxazol-3-ium iodide

Systemtic Name: 2-[3-[5-chloranyl-1-ethyl-3-(2-morpholin-4-ylethyl)benzimidazol-2-ylidene]prop-1-enyl]-3-ethyl-1,3-benzoxazol-3-ium iodide Openeye Name: 2-[3-[5-chloro-1-ethyl-3-(2-morpholinoethyl)benzimidazol-2-ylidene]prop-1-enyl]-3-ethyl-1,3-benzoxazol-3-ium iodide CAS Name: 2-[3-[5-chloro-1-ethyl-3-[2-(4-morpholinyl)ethyl]-2-benzimidazolylidene]prop-1-enyl]-3-ethyl-1,3-benzoxazol-3-ium iodide IUPAC Name: 2-[3-[5-chloro-1-ethyl-3-(2-morpholin-4-ylethyl)benzimidazol-2-ylidene]prop-1-enyl]-3-ethyl-1,3-benzoxazol-3-ium iodide Traditional Name: 2-[3-[5-chloro-1-ethyl-3-(2-morpholinoethyl)benzimidazol-2-ylidene]prop-1-enyl]-3-ethyl-1,3-benzoxazol-3-ium iodide Formula: C27H32ClIN4O2 MolecularWeight: 606.92605

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Descriptors Computed from Structure

Canonical SMILES:

CCN1C2=C(C=C(C=C2)Cl)N(C1=CC=CC3=[N+](C4=CC=CC=C4O3)CC)CCN5CCOCC5.[I-]

Isomeric SMILES

CCN1C2=C(C=C(C=C2)Cl)N(C1=CC=CC3=[N+](C4=CC=CC=C4O3)CC)CCN5CCOCC5.[I-]

InChI

InChI=1S/C27H32ClN4O2.HI/c1-3-30-22-13-12-21(28)20-24(22)32(15-14-29-16-18-33-19-17-29)26(30)10-7-11-27-31(4-2)23-8-5-6-9-25(23)34-27;/h5-13,20H,3-4,14-19H2,1-2H3;1H/q+1;/p-1