8-(2-azanylethanoylamino)octyl 9,10-bis(oxidanylidene)anthracene-2-carboxylate

Systemtic Name: 8-(2-azanylethanoylamino)octyl 9,10-bis(oxidanylidene)anthracene-2-carboxylate Openeye Name: 8-[(2-aminoacetyl)amino]octyl 9,10-dioxoanthracene-2-carboxylate CAS Name: 9,10-dioxo-2-anthracenecarboxylic acid 8-[(2-amino-1-oxoethyl)amino]octyl ester IUPAC Name: 8-[(2-aminoacetyl)amino]octyl 9,10-dioxoanthracene-2-carboxylate Traditional Name: 9,10-diketoanthracene-2-carboxylic acid 8-(glycylamino)octyl ester Formula: C25H28N2O5 MolecularWeight: 436.50022

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)C(=O)C3=C(C2=O)C=C(C=C3)C(=O)OCCCCCCCCNC(=O)CN

Isomeric SMILES

C1=CC=C2C(=C1)C(=O)C3=C(C2=O)C=C(C=C3)C(=O)OCCCCCCCCNC(=O)CN

InChI

InChI=1S/C25H28N2O5/c26-16-22(28)27-13-7-3-1-2-4-8-14-32-25(31)17-11-12-20-21(15-17)24(30)19-10-6-5-9-18(19)23(20)29/h5-6,9-12,15H,1-4,7-8,13-14,16,26H2,(H,27,28)