(2R)-2-[(2-benzamido-3-methyl-but-2-enoyl)amino]-3-phenyl-propanoate

Systemtic Name: (2R)-2-[(2-benzamido-3-methyl-but-2-enoyl)amino]-3-phenyl-propanoate Openeye Name: (2R)-2-[(2-benzamido-3-methyl-but-2-enoyl)amino]-3-phenyl-propanoate CAS Name: (2R)-2-[(2-benzamido-3-methyl-1-oxobut-2-enyl)amino]-3-phenylpropanoate IUPAC Name: (2R)-2-[(2-benzamido-3-methylbut-2-enoyl)amino]-3-phenylpropanoate Traditional Name: (2R)-2-[(2-benzamido-3-methyl-but-2-enoyl)amino]-3-phenyl-propionate Formula: C21H21N2O4- MolecularWeight: 365.40244

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Descriptors Computed from Structure

Canonical SMILES:

CC(=C(C(=O)NC(CC1=CC=CC=C1)C(=O)[O-])NC(=O)C2=CC=CC=C2)C

Isomeric SMILES

CC(=C(C(=O)N[C@H](CC1=CC=CC=C1)C(=O)[O-])NC(=O)C2=CC=CC=C2)C

InChI

InChI=1S/C21H22N2O4/c1-14(2)18(23-19(24)16-11-7-4-8-12-16)20(25)22-17(21(26)27)13-15-9-5-3-6-10-15/h3-12,17H,13H2,1-2H3,(H,22,25)(H,23,24)(H,26,27)/p-1/t17-/m1/s1