[[3-(1-adamantyl)-4-oxidanyl-phenyl]carbonylamino] 2-methylbenzoate

Systemtic Name: [[3-(1-adamantyl)-4-oxidanyl-phenyl]carbonylamino] 2-methylbenzoate Openeye Name: [[3-(1-adamantyl)-4-hydroxy-benzoyl]amino] 2-methylbenzoate CAS Name: 2-methylbenzoic acid [[[3-(1-adamantyl)-4-hydroxyphenyl]-oxomethyl]amino] ester IUPAC Name: [[3-(1-adamantyl)-4-hydroxybenzoyl]amino] 2-methylbenzoate Traditional Name: 2-methylbenzoic acid [[3-(1-adamantyl)-4-hydroxy-benzoyl]amino] ester Formula: C25H27NO4 MolecularWeight: 405.48618

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC=C1C(=O)ONC(=O)C2=CC(=C(C=C2)O)C34CC5CC(C3)CC(C5)C4

Isomeric SMILES

CC1=CC=CC=C1C(=O)ONC(=O)C2=CC(=C(C=C2)O)C34CC5CC(C3)CC(C5)C4

InChI

InChI=1S/C25H27NO4/c1-15-4-2-3-5-20(15)24(29)30-26-23(28)19-6-7-22(27)21(11-19)25-12-16-8-17(13-25)10-18(9-16)14-25/h2-7,11,16-18,27H,8-10,12-14H2,1H3,(H,26,28)