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2-[1,3-bis(oxidanylidene)inden-2-ylidene]-2-(octadecylamino)ethanenitrile

2-[1,3-bis(oxidanylidene)inden-2-ylidene]-2-(octadecylamino)ethanenitrile

Systemtic Name:2-[1,3-bis(oxidanylidene)inden-2-ylidene]-2-(octadecylamino)ethanenitrile
Openeye Name:2-(1,3-dioxoindan-2-ylidene)-2-(octadecylamino)acetonitrile
CAS Name:2-(1,3-dioxo-2-indenylidene)-2-(octadecylamino)acetonitrile
IUPAC Name:2-(1,3-dioxoinden-2-ylidene)-2-(octadecylamino)acetonitrile
Traditional Name:2-(1,3-diketoindan-2-ylidene)-2-(stearylamino)acetonitrile
Formula: C29H42N2O2
MolecularWeight: 450.65598
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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCCCCCCCNC(=C1C(=O)C2=CC=CC=C2C1=O)C#N


Isomeric SMILES

CCCCCCCCCCCCCCCCCCNC(=C1C(=O)C2=CC=CC=C2C1=O)C#N


InChI

InChI=1S/C29H42N2O2/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-16-19-22-31-26(23-30)27-28(32)24-20-17-18-21-25(24)29(27)33/h17-18,20-21,31H,2-16,19,22H2,1H3


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