3-[3-ethoxy-4-[(3-nitrophenyl)methoxy]-5-prop-2-enyl-phenyl]-2-(6-methyl-1H-benzimidazol-2-yl)prop-2-enenitrile

Systemtic Name: 3-[3-ethoxy-4-[(3-nitrophenyl)methoxy]-5-prop-2-enyl-phenyl]-2-(6-methyl-1H-benzimidazol-2-yl)prop-2-enenitrile Openeye Name: 3-[3-allyl-5-ethoxy-4-[(3-nitrophenyl)methoxy]phenyl]-2-(6-methyl-1H-benzimidazol-2-yl)prop-2-enenitrile CAS Name: 3-[3-ethoxy-4-[(3-nitrophenyl)methoxy]-5-prop-2-enylphenyl]-2-(6-methyl-1H-benzimidazol-2-yl)-2-propenenitrile IUPAC Name: 3-[3-ethoxy-4-[(3-nitrophenyl)methoxy]-5-prop-2-enylphenyl]-2-(6-methyl-1H-benzimidazol-2-yl)prop-2-enenitrile Traditional Name: 3-[3-allyl-5-ethoxy-4-(3-nitrobenzyl)oxy-phenyl]-2-(6-methyl-1H-benzimidazol-2-yl)acrylonitrile Formula: C29H26N4O4 MolecularWeight: 494.54114

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=CC(=CC(=C1OCC2=CC(=CC=C2)[N+](=O)[O-])CC=C)C=C(C#N)C3=NC4=C(N3)C=C(C=C4)C

Isomeric SMILES

CCOC1=CC(=CC(=C1OCC2=CC(=CC=C2)[N+](=O)[O-])CC=C)C=C(C#N)C3=NC4=C(N3)C=C(C=C4)C

InChI

InChI=1S/C29H26N4O4/c1-4-7-22-13-21(14-23(17-30)29-31-25-11-10-19(3)12-26(25)32-29)16-27(36-5-2)28(22)37-18-20-8-6-9-24(15-20)33(34)35/h4,6,8-16H,1,5,7,18H2,2-3H3,(H,31,32)