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

Systemtic Name: [2-[[4-(1-adamantyl)phenyl]amino]-2-oxidanylidene-ethyl] 2-benzamidobenzoate Openeye Name: [2-[4-(1-adamantyl)anilino]-2-oxo-ethyl] 2-benzamidobenzoate CAS Name: 2-benzamidobenzoic acid [2-[4-(1-adamantyl)anilino]-2-oxoethyl] ester IUPAC Name: [2-[4-(1-adamantyl)anilino]-2-oxoethyl] 2-benzamidobenzoate Traditional Name: 2-benzamidobenzoic acid [2-[4-(1-adamantyl)anilino]-2-keto-ethyl] ester Formula: C32H32N2O4 MolecularWeight: 508.60748

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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=C5NC(=O)C6=CC=CC=C6

Isomeric SMILES

C1C2CC3CC1CC(C2)(C3)C4=CC=C(C=C4)NC(=O)COC(=O)C5=CC=CC=C5NC(=O)C6=CC=CC=C6

InChI

InChI=1S/C32H32N2O4/c35-29(20-38-31(37)27-8-4-5-9-28(27)34-30(36)24-6-2-1-3-7-24)33-26-12-10-25(11-13-26)32-17-21-14-22(18-32)16-23(15-21)19-32/h1-13,21-23H,14-20H2,(H,33,35)(H,34,36)