ethyl (2S)-2-[2-(3-chlorophenyl)ethanoylamino]-3-(4-prop-2-enoxyimidazol-4-yl)propanoate

Systemtic Name: ethyl (2S)-2-[2-(3-chlorophenyl)ethanoylamino]-3-(4-prop-2-enoxyimidazol-4-yl)propanoate Openeye Name: ethyl (2S)-3-(4-allyloxyimidazol-4-yl)-2-[[2-(3-chlorophenyl)acetyl]amino]propanoate CAS Name: (2S)-2-[[2-(3-chlorophenyl)-1-oxoethyl]amino]-3-(4-prop-2-enoxy-4-imidazolyl)propanoic acid ethyl ester IUPAC Name: ethyl (2S)-2-[[2-(3-chlorophenyl)acetyl]amino]-3-(4-prop-2-enoxyimidazol-4-yl)propanoate Traditional Name: (2S)-3-(4-allyloxyimidazol-4-yl)-2-[[2-(3-chlorophenyl)acetyl]amino]propionic acid ethyl ester Formula: C19H22ClN3O4 MolecularWeight: 391.84868

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C(CC1(C=NC=N1)OCC=C)NC(=O)CC2=CC(=CC=C2)Cl

Isomeric SMILES

CCOC(=O)[C@H](CC1(C=NC=N1)OCC=C)NC(=O)CC2=CC(=CC=C2)Cl

InChI

InChI=1S/C19H22ClN3O4/c1-3-8-27-19(12-21-13-22-19)11-16(18(25)26-4-2)23-17(24)10-14-6-5-7-15(20)9-14/h3,5-7,9,12-13,16H,1,4,8,10-11H2,2H3,(H,23,24)/t16-,19?/m0/s1