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

Systemtic Name: methyl 2-[3-[2-[4-(1-adamantyl)phenoxy]ethanoylamino]phenyl]ethanoate Openeye Name: methyl 2-[3-[[2-[4-(1-adamantyl)phenoxy]acetyl]amino]phenyl]acetate CAS Name: 2-[3-[[2-[4-(1-adamantyl)phenoxy]-1-oxoethyl]amino]phenyl]acetic acid methyl ester IUPAC Name: methyl 2-[3-[[2-[4-(1-adamantyl)phenoxy]acetyl]amino]phenyl]acetate Traditional Name: 2-[3-[[2-[4-(1-adamantyl)phenoxy]acetyl]amino]phenyl]acetic acid methyl ester Formula: C27H31NO4 MolecularWeight: 433.53934

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)CC1=CC(=CC=C1)NC(=O)COC2=CC=C(C=C2)C34CC5CC(C3)CC(C5)C4

Isomeric SMILES

COC(=O)CC1=CC(=CC=C1)NC(=O)COC2=CC=C(C=C2)C34CC5CC(C3)CC(C5)C4

InChI

InChI=1S/C27H31NO4/c1-31-26(30)13-18-3-2-4-23(12-18)28-25(29)17-32-24-7-5-22(6-8-24)27-14-19-9-20(15-27)11-21(10-19)16-27/h2-8,12,19-21H,9-11,13-17H2,1H3,(H,28,29)