[9,10-bis(oxidanylidene)anthracen-2-yl]methyl 4-(phenylmethoxycarbonylamino)butanoate

Systemtic Name: [9,10-bis(oxidanylidene)anthracen-2-yl]methyl 4-(phenylmethoxycarbonylamino)butanoate Openeye Name: (9,10-dioxo-2-anthryl)methyl 4-(benzyloxycarbonylamino)butanoate CAS Name: 4-(phenylmethoxycarbonylamino)butanoic acid (9,10-dioxo-2-anthracenyl)methyl ester IUPAC Name: (9,10-dioxoanthracen-2-yl)methyl 4-(phenylmethoxycarbonylamino)butanoate Traditional Name: 4-(benzyloxycarbonylamino)butyric acid (9,10-diketo-2-anthryl)methyl ester Formula: C27H23NO6 MolecularWeight: 457.47462

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)COC(=O)NCCCC(=O)OCC2=CC3=C(C=C2)C(=O)C4=CC=CC=C4C3=O

Isomeric SMILES

C1=CC=C(C=C1)COC(=O)NCCCC(=O)OCC2=CC3=C(C=C2)C(=O)C4=CC=CC=C4C3=O

InChI

InChI=1S/C27H23NO6/c29-24(11-6-14-28-27(32)34-16-18-7-2-1-3-8-18)33-17-19-12-13-22-23(15-19)26(31)21-10-5-4-9-20(21)25(22)30/h1-5,7-10,12-13,15H,6,11,14,16-17H2,(H,28,32)