ethyl (E)-3-[[5-chloranyl-9,10-bis(oxidanylidene)anthracen-1-yl]amino]-2-cyano-prop-2-enoate

Systemtic Name: ethyl (E)-3-[[5-chloranyl-9,10-bis(oxidanylidene)anthracen-1-yl]amino]-2-cyano-prop-2-enoate Openeye Name: ethyl (E)-3-[(5-chloro-9,10-dioxo-1-anthryl)amino]-2-cyano-prop-2-enoate CAS Name: (E)-3-[(5-chloro-9,10-dioxo-1-anthracenyl)amino]-2-cyano-2-propenoic acid ethyl ester IUPAC Name: ethyl (E)-3-[(5-chloro-9,10-dioxoanthracen-1-yl)amino]-2-cyanoprop-2-enoate Traditional Name: (E)-3-[(5-chloro-9,10-diketo-1-anthryl)amino]-2-cyano-acrylic acid ethyl ester Formula: C20H13ClN2O4 MolecularWeight: 380.78122

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C(=CNC1=CC=CC2=C1C(=O)C3=C(C2=O)C(=CC=C3)Cl)C#N

Isomeric SMILES

CCOC(=O)/C(=C/NC1=CC=CC2=C1C(=O)C3=C(C2=O)C(=CC=C3)Cl)/C#N

InChI

InChI=1S/C20H13ClN2O4/c1-2-27-20(26)11(9-22)10-23-15-8-4-6-13-17(15)19(25)12-5-3-7-14(21)16(12)18(13)24/h3-8,10,23H,2H2,1H3/b11-10+