methyl 3-[4-(azetidin-1-ylcarbonyl)phenoxy]-5-[(2S)-1-phenylmethoxypropan-2-yl]oxy-benzoate

Systemtic Name: methyl 3-[4-(azetidin-1-ylcarbonyl)phenoxy]-5-[(2S)-1-phenylmethoxypropan-2-yl]oxy-benzoate Openeye Name: methyl 3-[4-(azetidine-1-carbonyl)phenoxy]-5-[(1S)-2-benzyloxy-1-methyl-ethoxy]benzoate CAS Name: 3-[4-[1-azetidinyl(oxo)methyl]phenoxy]-5-[(2S)-1-phenylmethoxypropan-2-yl]oxybenzoic acid methyl ester IUPAC Name: methyl 3-[4-(azetidine-1-carbonyl)phenoxy]-5-[(2S)-1-phenylmethoxypropan-2-yl]oxybenzoate Traditional Name: 3-[4-(azetidine-1-carbonyl)phenoxy]-5-[(1S)-2-benzoxy-1-methyl-ethoxy]benzoic acid methyl ester Formula: C28H29NO6 MolecularWeight: 475.53296

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Descriptors Computed from Structure

Canonical SMILES:

CC(COCC1=CC=CC=C1)OC2=CC(=CC(=C2)OC3=CC=C(C=C3)C(=O)N4CCC4)C(=O)OC

Isomeric SMILES

C[C@@H](COCC1=CC=CC=C1)OC2=CC(=CC(=C2)OC3=CC=C(C=C3)C(=O)N4CCC4)C(=O)OC

InChI

InChI=1S/C28H29NO6/c1-20(18-33-19-21-7-4-3-5-8-21)34-25-15-23(28(31)32-2)16-26(17-25)35-24-11-9-22(10-12-24)27(30)29-13-6-14-29/h3-5,7-12,15-17,20H,6,13-14,18-19H2,1-2H3/t20-/m0/s1