(2Z)-3-butyl-2-[(E)-3-(3-butyl-5-phenyl-1,3-benzoxazol-3-ium-2-yl)-2-methyl-prop-2-enylidene]-5-phenyl-1,3-benzoxazole

Systemtic Name: (2Z)-3-butyl-2-[(E)-3-(3-butyl-5-phenyl-1,3-benzoxazol-3-ium-2-yl)-2-methyl-prop-2-enylidene]-5-phenyl-1,3-benzoxazole Openeye Name: (2Z)-3-butyl-2-[(E)-3-(3-butyl-5-phenyl-1,3-benzoxazol-3-ium-2-yl)-2-methyl-prop-2-enylidene]-5-phenyl-1,3-benzoxazole CAS Name: (2Z)-3-butyl-2-[(E)-3-(3-butyl-5-phenyl-1,3-benzoxazol-3-ium-2-yl)-2-methylprop-2-enylidene]-5-phenyl-1,3-benzoxazole IUPAC Name: (2Z)-3-butyl-2-[(E)-3-(3-butyl-5-phenyl-1,3-benzoxazol-3-ium-2-yl)-2-methylprop-2-enylidene]-5-phenyl-1,3-benzoxazole Traditional Name: (2Z)-3-butyl-2-[(E)-3-(3-butyl-5-phenyl-1,3-benzoxazol-3-ium-2-yl)-2-methyl-prop-2-enylidene]-5-phenyl-1,3-benzoxazole Formula: C38H39N2O2+ MolecularWeight: 555.72846

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Descriptors Computed from Structure

Canonical SMILES:

CCCCN1C2=C(C=CC(=C2)C3=CC=CC=C3)OC1=CC(=CC4=[N+](C5=C(O4)C=CC(=C5)C6=CC=CC=C6)CCCC)C

Isomeric SMILES

CCCCN\1C2=C(C=CC(=C2)C3=CC=CC=C3)O/C1=C\C(=C\C4=[N+](C5=C(O4)C=CC(=C5)C6=CC=CC=C6)CCCC)\C

InChI

InChI=1S/C38H39N2O2/c1-4-6-22-39-33-26-31(29-14-10-8-11-15-29)18-20-35(33)41-37(39)24-28(3)25-38-40(23-7-5-2)34-27-32(19-21-36(34)42-38)30-16-12-9-13-17-30/h8-21,24-27H,4-7,22-23H2,1-3H3/q+1