(E)-3-[1-[(4-nitrophenyl)methyl]indol-3-yl]-2-(phenylcarbonyl)prop-2-enenitrile

Systemtic Name: (E)-3-[1-[(4-nitrophenyl)methyl]indol-3-yl]-2-(phenylcarbonyl)prop-2-enenitrile Openeye Name: (E)-2-benzoyl-3-[1-[(4-nitrophenyl)methyl]indol-3-yl]prop-2-enenitrile CAS Name: (E)-2-benzoyl-3-[1-[(4-nitrophenyl)methyl]-3-indolyl]-2-propenenitrile IUPAC Name: (E)-2-benzoyl-3-[1-[(4-nitrophenyl)methyl]indol-3-yl]prop-2-enenitrile Traditional Name: (E)-2-benzoyl-3-[1-(4-nitrobenzyl)indol-3-yl]acrylonitrile Formula: C25H17N3O3 MolecularWeight: 407.42078

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)C(=O)C(=CC2=CN(C3=CC=CC=C32)CC4=CC=C(C=C4)[N+](=O)[O-])C#N

Isomeric SMILES

C1=CC=C(C=C1)C(=O)/C(=C/C2=CN(C3=CC=CC=C32)CC4=CC=C(C=C4)[N+](=O)[O-])/C#N

InChI

InChI=1S/C25H17N3O3/c26-15-20(25(29)19-6-2-1-3-7-19)14-21-17-27(24-9-5-4-8-23(21)24)16-18-10-12-22(13-11-18)28(30)31/h1-14,17H,16H2/b20-14+