(E)-3-[1-[(2-fluorophenyl)methyl]-2-methyl-indol-3-yl]-2-(3-nitrophenyl)carbonyl-prop-2-enenitrile

Systemtic Name: (E)-3-[1-[(2-fluorophenyl)methyl]-2-methyl-indol-3-yl]-2-(3-nitrophenyl)carbonyl-prop-2-enenitrile Openeye Name: (E)-3-[1-[(2-fluorophenyl)methyl]-2-methyl-indol-3-yl]-2-(3-nitrobenzoyl)prop-2-enenitrile CAS Name: (E)-3-[1-[(2-fluorophenyl)methyl]-2-methyl-3-indolyl]-2-[(3-nitrophenyl)-oxomethyl]-2-propenenitrile IUPAC Name: (E)-3-[1-[(2-fluorophenyl)methyl]-2-methylindol-3-yl]-2-(3-nitrobenzoyl)prop-2-enenitrile Traditional Name: (E)-3-[1-(2-fluorobenzyl)-2-methyl-indol-3-yl]-2-(3-nitrobenzoyl)acrylonitrile Formula: C26H18FN3O3 MolecularWeight: 439.437823

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C2=CC=CC=C2N1CC3=CC=CC=C3F)C=C(C#N)C(=O)C4=CC(=CC=C4)[N+](=O)[O-]

Isomeric SMILES

CC1=C(C2=CC=CC=C2N1CC3=CC=CC=C3F)/C=C(\C#N)/C(=O)C4=CC(=CC=C4)[N+](=O)[O-]

InChI

InChI=1S/C26H18FN3O3/c1-17-23(14-20(15-28)26(31)18-8-6-9-21(13-18)30(32)33)22-10-3-5-12-25(22)29(17)16-19-7-2-4-11-24(19)27/h2-14H,16H2,1H3/b20-14+