(3R)-3-(2,4-dimethylphenyl)-3-(7-ethyl-1H-indol-3-yl)propanoate

Systemtic Name: (3R)-3-(2,4-dimethylphenyl)-3-(7-ethyl-1H-indol-3-yl)propanoate Openeye Name: (3R)-3-(2,4-dimethylphenyl)-3-(7-ethyl-1H-indol-3-yl)propanoate CAS Name: (3R)-3-(2,4-dimethylphenyl)-3-(7-ethyl-1H-indol-3-yl)propanoate IUPAC Name: (3R)-3-(2,4-dimethylphenyl)-3-(7-ethyl-1H-indol-3-yl)propanoate Traditional Name: (3R)-3-(2,4-dimethylphenyl)-3-(7-ethyl-1H-indol-3-yl)propionate Formula: C21H22NO2- MolecularWeight: 320.40488

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=CC=CC2=C1NC=C2C(CC(=O)[O-])C3=C(C=C(C=C3)C)C

Isomeric SMILES

CCC1=CC=CC2=C1NC=C2[C@H](CC(=O)[O-])C3=C(C=C(C=C3)C)C

InChI

InChI=1S/C21H23NO2/c1-4-15-6-5-7-17-19(12-22-21(15)17)18(11-20(23)24)16-9-8-13(2)10-14(16)3/h5-10,12,18,22H,4,11H2,1-3H3,(H,23,24)/p-1/t18-/m1/s1