methyl 2-[2-(1-adamantyl)ethanoylamino]-3,4,5-trimethoxy-benzoate

Systemtic Name: methyl 2-[2-(1-adamantyl)ethanoylamino]-3,4,5-trimethoxy-benzoate Openeye Name: methyl 2-[[2-(1-adamantyl)acetyl]amino]-3,4,5-trimethoxy-benzoate CAS Name: 2-[[2-(1-adamantyl)-1-oxoethyl]amino]-3,4,5-trimethoxybenzoic acid methyl ester IUPAC Name: methyl 2-[[2-(1-adamantyl)acetyl]amino]-3,4,5-trimethoxybenzoate Traditional Name: 2-[[2-(1-adamantyl)acetyl]amino]-3,4,5-trimethoxy-benzoic acid methyl ester Formula: C23H31NO6 MolecularWeight: 417.49534

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C(=C(C(=C1)C(=O)OC)NC(=O)CC23CC4CC(C2)CC(C4)C3)OC)OC

Isomeric SMILES

COC1=C(C(=C(C(=C1)C(=O)OC)NC(=O)CC23CC4CC(C2)CC(C4)C3)OC)OC

InChI

InChI=1S/C23H31NO6/c1-27-17-8-16(22(26)30-4)19(21(29-3)20(17)28-2)24-18(25)12-23-9-13-5-14(10-23)7-15(6-13)11-23/h8,13-15H,5-7,9-12H2,1-4H3,(H,24,25)