methyl 2-[2-[3-(4-methylphenyl)-1-adamantyl]ethanoylamino]ethanoate

Systemtic Name: methyl 2-[2-[3-(4-methylphenyl)-1-adamantyl]ethanoylamino]ethanoate Openeye Name: methyl 2-[[2-[3-(p-tolyl)-1-adamantyl]acetyl]amino]acetate CAS Name: 2-[[2-[3-(4-methylphenyl)-1-adamantyl]-1-oxoethyl]amino]acetic acid methyl ester IUPAC Name: methyl 2-[[2-[3-(4-methylphenyl)-1-adamantyl]acetyl]amino]acetate Traditional Name: 2-[[2-[3-(p-tolyl)-1-adamantyl]acetyl]amino]acetic acid methyl ester Formula: C22H29NO3 MolecularWeight: 355.47056

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)C23CC4CC(C2)CC(C4)(C3)CC(=O)NCC(=O)OC

Isomeric SMILES

CC1=CC=C(C=C1)C23CC4CC(C2)CC(C4)(C3)CC(=O)NCC(=O)OC

InChI

InChI=1S/C22H29NO3/c1-15-3-5-18(6-4-15)22-10-16-7-17(11-22)9-21(8-16,14-22)12-19(24)23-13-20(25)26-2/h3-6,16-17H,7-14H2,1-2H3,(H,23,24)