[(Z)-1-[9,10-bis(oxidanylidene)anthracen-1-yl]-3-phenoxy-prop-1-en-2-yl]-diethyl-azanium

Systemtic Name: [(Z)-1-[9,10-bis(oxidanylidene)anthracen-1-yl]-3-phenoxy-prop-1-en-2-yl]-diethyl-azanium Openeye Name: [(Z)-2-(9,10-dioxo-1-anthryl)-1-(phenoxymethyl)vinyl]-diethyl-ammonium CAS Name: [(Z)-1-(9,10-dioxo-1-anthracenyl)-3-phenoxyprop-1-en-2-yl]-diethylammonium IUPAC Name: [(Z)-1-(9,10-dioxoanthracen-1-yl)-3-phenoxyprop-1-en-2-yl]-diethylazanium Traditional Name: [(Z)-2-(9,10-diketo-1-anthryl)-1-(phenoxymethyl)vinyl]-diethyl-ammonium Formula: C27H26NO3+ MolecularWeight: 412.50024

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Descriptors Computed from Structure

Canonical SMILES:

CC[NH+](CC)C(=CC1=CC=CC2=C1C(=O)C3=CC=CC=C3C2=O)COC4=CC=CC=C4

Isomeric SMILES

CC[NH+](CC)/C(=C\C1=CC=CC2=C1C(=O)C3=CC=CC=C3C2=O)/COC4=CC=CC=C4

InChI

InChI=1S/C27H25NO3/c1-3-28(4-2)20(18-31-21-12-6-5-7-13-21)17-19-11-10-16-24-25(19)27(30)23-15-9-8-14-22(23)26(24)29/h5-17H,3-4,18H2,1-2H3/p+1/b20-17-