[(2S)-1-(anthracen-9-ylmethoxy)-3-methyl-1-oxidanylidene-butan-2-yl] naphthalene-2-carboxylate

Systemtic Name: [(2S)-1-(anthracen-9-ylmethoxy)-3-methyl-1-oxidanylidene-butan-2-yl] naphthalene-2-carboxylate Openeye Name: [(1S)-1-(9-anthrylmethoxycarbonyl)-2-methyl-propyl] naphthalene-2-carboxylate CAS Name: 2-naphthalenecarboxylic acid [(2S)-1-(9-anthracenylmethoxy)-3-methyl-1-oxobutan-2-yl] ester IUPAC Name: [(2S)-1-(anthracen-9-ylmethoxy)-3-methyl-1-oxobutan-2-yl] naphthalene-2-carboxylate Traditional Name: naphthalene-2-carboxylic acid [(1S)-1-(9-anthrylmethoxycarbonyl)-2-methyl-propyl] ester Formula: C31H26O4 MolecularWeight: 462.53574

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C(C(=O)OCC1=C2C=CC=CC2=CC3=CC=CC=C31)OC(=O)C4=CC5=CC=CC=C5C=C4

Isomeric SMILES

CC(C)[C@@H](C(=O)OCC1=C2C=CC=CC2=CC3=CC=CC=C31)OC(=O)C4=CC5=CC=CC=C5C=C4

InChI

InChI=1S/C31H26O4/c1-20(2)29(35-30(32)25-16-15-21-9-3-4-10-22(21)17-25)31(33)34-19-28-26-13-7-5-11-23(26)18-24-12-6-8-14-27(24)28/h3-18,20,29H,19H2,1-2H3/t29-/m0/s1