[2-oxidanylidene-2-(3-phenylpropylamino)ethyl] 9,10-bis(oxidanylidene)anthracene-1-carboxylate

Systemtic Name: [2-oxidanylidene-2-(3-phenylpropylamino)ethyl] 9,10-bis(oxidanylidene)anthracene-1-carboxylate Openeye Name: [2-oxo-2-(3-phenylpropylamino)ethyl] 9,10-dioxoanthracene-1-carboxylate CAS Name: 9,10-dioxo-1-anthracenecarboxylic acid [2-oxo-2-(3-phenylpropylamino)ethyl] ester IUPAC Name: [2-oxo-2-(3-phenylpropylamino)ethyl] 9,10-dioxoanthracene-1-carboxylate Traditional Name: 9,10-diketoanthracene-1-carboxylic acid [2-keto-2-(3-phenylpropylamino)ethyl] ester Formula: C26H21NO5 MolecularWeight: 427.44864

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)CCCNC(=O)COC(=O)C2=CC=CC3=C2C(=O)C4=CC=CC=C4C3=O

Isomeric SMILES

C1=CC=C(C=C1)CCCNC(=O)COC(=O)C2=CC=CC3=C2C(=O)C4=CC=CC=C4C3=O

InChI

InChI=1S/C26H21NO5/c28-22(27-15-7-10-17-8-2-1-3-9-17)16-32-26(31)21-14-6-13-20-23(21)25(30)19-12-5-4-11-18(19)24(20)29/h1-6,8-9,11-14H,7,10,15-16H2,(H,27,28)