[2-oxidanylidene-2-[[(2S)-2-phenylpropyl]amino]ethyl] anthracene-9-carboxylate

Systemtic Name: [2-oxidanylidene-2-[[(2S)-2-phenylpropyl]amino]ethyl] anthracene-9-carboxylate Openeye Name: [2-oxo-2-[[(2S)-2-phenylpropyl]amino]ethyl] anthracene-9-carboxylate CAS Name: 9-anthracenecarboxylic acid [2-oxo-2-[[(2S)-2-phenylpropyl]amino]ethyl] ester IUPAC Name: [2-oxo-2-[[(2S)-2-phenylpropyl]amino]ethyl] anthracene-9-carboxylate Traditional Name: anthracene-9-carboxylic acid [2-keto-2-[[(2S)-2-phenylpropyl]amino]ethyl] ester Formula: C26H23NO3 MolecularWeight: 397.46572

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Descriptors Computed from Structure

Canonical SMILES:

CC(CNC(=O)COC(=O)C1=C2C=CC=CC2=CC3=CC=CC=C31)C4=CC=CC=C4

Isomeric SMILES

C[C@H](CNC(=O)COC(=O)C1=C2C=CC=CC2=CC3=CC=CC=C31)C4=CC=CC=C4

InChI

InChI=1S/C26H23NO3/c1-18(19-9-3-2-4-10-19)16-27-24(28)17-30-26(29)25-22-13-7-5-11-20(22)15-21-12-6-8-14-23(21)25/h2-15,18H,16-17H2,1H3,(H,27,28)/t18-/m1/s1