[2-[[4-(1-adamantyl)phenyl]amino]-2-oxidanylidene-ethyl] 2-phenylazanylbenzoate

Systemtic Name: [2-[[4-(1-adamantyl)phenyl]amino]-2-oxidanylidene-ethyl] 2-phenylazanylbenzoate Openeye Name: [2-[4-(1-adamantyl)anilino]-2-oxo-ethyl] 2-anilinobenzoate CAS Name: 2-anilinobenzoic acid [2-[4-(1-adamantyl)anilino]-2-oxoethyl] ester IUPAC Name: [2-[4-(1-adamantyl)anilino]-2-oxoethyl] 2-anilinobenzoate Traditional Name: 2-anilinobenzoic acid [2-[4-(1-adamantyl)anilino]-2-keto-ethyl] ester Formula: C31H32N2O3 MolecularWeight: 480.59738

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Descriptors Computed from Structure

Canonical SMILES:

C1C2CC3CC1CC(C2)(C3)C4=CC=C(C=C4)NC(=O)COC(=O)C5=CC=CC=C5NC6=CC=CC=C6

Isomeric SMILES

C1C2CC3CC1CC(C2)(C3)C4=CC=C(C=C4)NC(=O)COC(=O)C5=CC=CC=C5NC6=CC=CC=C6

InChI

InChI=1S/C31H32N2O3/c34-29(20-36-30(35)27-8-4-5-9-28(27)32-25-6-2-1-3-7-25)33-26-12-10-24(11-13-26)31-17-21-14-22(18-31)16-23(15-21)19-31/h1-13,21-23,32H,14-20H2,(H,33,34)