2-[(E)-2-(3-ethyl-1,3-benzoxazol-3-ium-2-yl)ethenyl]-4-methyl-3-phenyl-1,4-benzoxazine

Systemtic Name: 2-[(E)-2-(3-ethyl-1,3-benzoxazol-3-ium-2-yl)ethenyl]-4-methyl-3-phenyl-1,4-benzoxazine Openeye Name: 2-[(E)-2-(3-ethyl-1,3-benzoxazol-3-ium-2-yl)vinyl]-4-methyl-3-phenyl-1,4-benzoxazine CAS Name: 2-[(E)-2-(3-ethyl-1,3-benzoxazol-3-ium-2-yl)ethenyl]-4-methyl-3-phenyl-1,4-benzoxazine IUPAC Name: 2-[(E)-2-(3-ethyl-1,3-benzoxazol-3-ium-2-yl)ethenyl]-4-methyl-3-phenyl-1,4-benzoxazine Traditional Name: 2-[(E)-2-(3-ethyl-1,3-benzoxazol-3-ium-2-yl)vinyl]-4-methyl-3-phenyl-1,4-benzoxazine Formula: C26H23N2O2+ MolecularWeight: 395.47302

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Descriptors Computed from Structure

Canonical SMILES:

CC[N+]1=C(OC2=CC=CC=C21)C=CC3=C(N(C4=CC=CC=C4O3)C)C5=CC=CC=C5

Isomeric SMILES

CC[N+]1=C(OC2=CC=CC=C21)/C=C/C3=C(N(C4=CC=CC=C4O3)C)C5=CC=CC=C5

InChI

InChI=1S/C26H23N2O2/c1-3-28-21-14-8-10-16-23(21)30-25(28)18-17-24-26(19-11-5-4-6-12-19)27(2)20-13-7-9-15-22(20)29-24/h4-18H,3H2,1-2H3/q+1