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methyl 3-[1-adamantyl(ethyl)carbamoyl]benzoate

methyl 3-[1-adamantyl(ethyl)carbamoyl]benzoate

Systemtic Name:methyl 3-[1-adamantyl(ethyl)carbamoyl]benzoate
Openeye Name:methyl 3-[1-adamantyl(ethyl)carbamoyl]benzoate
CAS Name:3-[[1-adamantyl(ethyl)amino]-oxomethyl]benzoic acid methyl ester
IUPAC Name:methyl 3-[1-adamantyl(ethyl)carbamoyl]benzoate
Traditional Name:3-[1-adamantyl(ethyl)carbamoyl]benzoic acid methyl ester
Formula: C21H27NO3
MolecularWeight: 341.44398
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Descriptors Computed from Structure

Canonical SMILES:

CCN(C(=O)C1=CC(=CC=C1)C(=O)OC)C23CC4CC(C2)CC(C4)C3


Isomeric SMILES

CCN(C(=O)C1=CC(=CC=C1)C(=O)OC)C23CC4CC(C2)CC(C4)C3


InChI

InChI=1S/C21H27NO3/c1-3-22(19(23)17-5-4-6-18(10-17)20(24)25-2)21-11-14-7-15(12-21)9-16(8-14)13-21/h4-6,10,14-16H,3,7-9,11-13H2,1-2H3


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