(phenylmethyl) (2S)-2-[2-methyl-1-(phenylmethyl)indol-4-yl]oxypropanoate

Systemtic Name: (phenylmethyl) (2S)-2-[2-methyl-1-(phenylmethyl)indol-4-yl]oxypropanoate Openeye Name: benzyl (2S)-2-(1-benzyl-2-methyl-indol-4-yl)oxypropanoate CAS Name: (2S)-2-[[2-methyl-1-(phenylmethyl)-4-indolyl]oxy]propanoic acid (phenylmethyl) ester IUPAC Name: benzyl (2S)-2-(1-benzyl-2-methylindol-4-yl)oxypropanoate Traditional Name: (2S)-2-(1-benzyl-2-methyl-indol-4-yl)oxypropionic acid benzyl ester Formula: C26H25NO3 MolecularWeight: 399.4816

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC2=C(N1CC3=CC=CC=C3)C=CC=C2OC(C)C(=O)OCC4=CC=CC=C4

Isomeric SMILES

CC1=CC2=C(N1CC3=CC=CC=C3)C=CC=C2O[C@@H](C)C(=O)OCC4=CC=CC=C4

InChI

InChI=1S/C26H25NO3/c1-19-16-23-24(27(19)17-21-10-5-3-6-11-21)14-9-15-25(23)30-20(2)26(28)29-18-22-12-7-4-8-13-22/h3-16,20H,17-18H2,1-2H3/t20-/m0/s1