methyl 2-[2-(3-chloranyl-4-prop-2-enoxy-phenyl)ethanoylamino]-3-phenyl-propanoate

Systemtic Name: methyl 2-[2-(3-chloranyl-4-prop-2-enoxy-phenyl)ethanoylamino]-3-phenyl-propanoate Openeye Name: methyl 2-[[2-(4-allyloxy-3-chloro-phenyl)acetyl]amino]-3-phenyl-propanoate CAS Name: 2-[[2-(3-chloro-4-prop-2-enoxyphenyl)-1-oxoethyl]amino]-3-phenylpropanoic acid methyl ester IUPAC Name: methyl 2-[[2-(3-chloro-4-prop-2-enoxyphenyl)acetyl]amino]-3-phenylpropanoate Traditional Name: 2-[[2-(4-allyloxy-3-chloro-phenyl)acetyl]amino]-3-phenyl-propionic acid methyl ester Formula: C21H22ClNO4 MolecularWeight: 387.85668

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C(CC1=CC=CC=C1)NC(=O)CC2=CC(=C(C=C2)OCC=C)Cl

Isomeric SMILES

COC(=O)C(CC1=CC=CC=C1)NC(=O)CC2=CC(=C(C=C2)OCC=C)Cl

InChI

InChI=1S/C21H22ClNO4/c1-3-11-27-19-10-9-16(12-17(19)22)14-20(24)23-18(21(25)26-2)13-15-7-5-4-6-8-15/h3-10,12,18H,1,11,13-14H2,2H3,(H,23,24)