methyl 2-[2-[2-(cyclohexen-1-yl)ethanoylamino]propanoylamino]-3-phenyl-propanoate

Systemtic Name: methyl 2-[2-[2-(cyclohexen-1-yl)ethanoylamino]propanoylamino]-3-phenyl-propanoate Openeye Name: methyl 2-[2-[[2-(cyclohexen-1-yl)acetyl]amino]propanoylamino]-3-phenyl-propanoate CAS Name: 2-[[2-[[2-(1-cyclohexenyl)-1-oxoethyl]amino]-1-oxopropyl]amino]-3-phenylpropanoic acid methyl ester IUPAC Name: methyl 2-[2-[[2-(cyclohexen-1-yl)acetyl]amino]propanoylamino]-3-phenylpropanoate Traditional Name: 2-[2-[[2-(cyclohexen-1-yl)acetyl]amino]propanoylamino]-3-phenyl-propionic acid methyl ester Formula: C21H28N2O4 MolecularWeight: 372.45802

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)NC(CC1=CC=CC=C1)C(=O)OC)NC(=O)CC2=CCCCC2

Isomeric SMILES

CC(C(=O)NC(CC1=CC=CC=C1)C(=O)OC)NC(=O)CC2=CCCCC2

InChI

InChI=1S/C21H28N2O4/c1-15(22-19(24)14-17-11-7-4-8-12-17)20(25)23-18(21(26)27-2)13-16-9-5-3-6-10-16/h3,5-6,9-11,15,18H,4,7-8,12-14H2,1-2H3,(H,22,24)(H,23,25)