methyl 4-[2-[[(1R)-1-(1-adamantyl)ethyl]amino]-2-oxidanylidene-ethoxy]benzoate

Systemtic Name: methyl 4-[2-[[(1R)-1-(1-adamantyl)ethyl]amino]-2-oxidanylidene-ethoxy]benzoate Openeye Name: methyl 4-[2-[[(1R)-1-(1-adamantyl)ethyl]amino]-2-oxo-ethoxy]benzoate CAS Name: 4-[2-[[(1R)-1-(1-adamantyl)ethyl]amino]-2-oxoethoxy]benzoic acid methyl ester IUPAC Name: methyl 4-[2-[[(1R)-1-(1-adamantyl)ethyl]amino]-2-oxoethoxy]benzoate Traditional Name: 4-[2-[[(1R)-1-(1-adamantyl)ethyl]amino]-2-keto-ethoxy]benzoic acid methyl ester Formula: C22H29NO4 MolecularWeight: 371.46996

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Descriptors Computed from Structure

Canonical SMILES:

CC(C12CC3CC(C1)CC(C3)C2)NC(=O)COC4=CC=C(C=C4)C(=O)OC

Isomeric SMILES

C[C@H](C12CC3CC(C1)CC(C3)C2)NC(=O)COC4=CC=C(C=C4)C(=O)OC

InChI

InChI=1S/C22H29NO4/c1-14(22-10-15-7-16(11-22)9-17(8-15)12-22)23-20(24)13-27-19-5-3-18(4-6-19)21(25)26-2/h3-6,14-17H,7-13H2,1-2H3,(H,23,24)/t14-,15?,16?,17?,22?/m1/s1