ethyl 2-azanyl-2-[4-[9,10-bis(oxidanylidene)anthracen-1-yl]piperazin-1-yl]ethanoate

Systemtic Name: ethyl 2-azanyl-2-[4-[9,10-bis(oxidanylidene)anthracen-1-yl]piperazin-1-yl]ethanoate Openeye Name: ethyl 2-amino-2-[4-(9,10-dioxo-1-anthryl)piperazin-1-yl]acetate CAS Name: 2-amino-2-[4-(9,10-dioxo-1-anthracenyl)-1-piperazinyl]acetic acid ethyl ester IUPAC Name: ethyl 2-amino-2-[4-(9,10-dioxoanthracen-1-yl)piperazin-1-yl]acetate Traditional Name: 2-amino-2-[4-(9,10-diketo-1-anthryl)piperazino]acetic acid ethyl ester Formula: C22H23N3O4 MolecularWeight: 393.43572

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C(N)N1CCN(CC1)C2=CC=CC3=C2C(=O)C4=CC=CC=C4C3=O

Isomeric SMILES

CCOC(=O)C(N)N1CCN(CC1)C2=CC=CC3=C2C(=O)C4=CC=CC=C4C3=O

InChI

InChI=1S/C22H23N3O4/c1-2-29-22(28)21(23)25-12-10-24(11-13-25)17-9-5-8-16-18(17)20(27)15-7-4-3-6-14(15)19(16)26/h3-9,21H,2,10-13,23H2,1H3