[2-oxidanylidene-2-(1-phenylbutylamino)ethyl] 9,10-bis(oxidanylidene)anthracene-1-carboxylate

Systemtic Name: [2-oxidanylidene-2-(1-phenylbutylamino)ethyl] 9,10-bis(oxidanylidene)anthracene-1-carboxylate Openeye Name: [2-oxo-2-(1-phenylbutylamino)ethyl] 9,10-dioxoanthracene-1-carboxylate CAS Name: 9,10-dioxo-1-anthracenecarboxylic acid [2-oxo-2-(1-phenylbutylamino)ethyl] ester IUPAC Name: [2-oxo-2-(1-phenylbutylamino)ethyl] 9,10-dioxoanthracene-1-carboxylate Traditional Name: 9,10-diketoanthracene-1-carboxylic acid [2-keto-2-(1-phenylbutylamino)ethyl] ester Formula: C27H23NO5 MolecularWeight: 441.47522

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Descriptors Computed from Structure

Canonical SMILES:

CCCC(C1=CC=CC=C1)NC(=O)COC(=O)C2=CC=CC3=C2C(=O)C4=CC=CC=C4C3=O

Isomeric SMILES

CCCC(C1=CC=CC=C1)NC(=O)COC(=O)C2=CC=CC3=C2C(=O)C4=CC=CC=C4C3=O

InChI

InChI=1S/C27H23NO5/c1-2-9-22(17-10-4-3-5-11-17)28-23(29)16-33-27(32)21-15-8-14-20-24(21)26(31)19-13-7-6-12-18(19)25(20)30/h3-8,10-15,22H,2,9,16H2,1H3,(H,28,29)