methyl 4-[2-[[(1R)-1-(1-adamantyl)ethyl]amino]-2-oxidanylidene-ethoxy]-3-methoxy-benzoate

Systemtic Name: methyl 4-[2-[[(1R)-1-(1-adamantyl)ethyl]amino]-2-oxidanylidene-ethoxy]-3-methoxy-benzoate Openeye Name: methyl 4-[2-[[(1R)-1-(1-adamantyl)ethyl]amino]-2-oxo-ethoxy]-3-methoxy-benzoate CAS Name: 4-[2-[[(1R)-1-(1-adamantyl)ethyl]amino]-2-oxoethoxy]-3-methoxybenzoic acid methyl ester IUPAC Name: methyl 4-[2-[[(1R)-1-(1-adamantyl)ethyl]amino]-2-oxoethoxy]-3-methoxybenzoate Traditional Name: 4-[2-[[(1R)-1-(1-adamantyl)ethyl]amino]-2-keto-ethoxy]-3-methoxy-benzoic acid methyl ester Formula: C23H31NO5 MolecularWeight: 401.49594

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C23H31NO5/c1-14(23-10-15-6-16(11-23)8-17(7-15)12-23)24-21(25)13-29-19-5-4-18(22(26)28-3)9-20(19)27-2/h4-5,9,14-17H,6-8,10-13H2,1-3H3,(H,24,25)/t14-,15?,16?,17?,23?/m1/s1