methyl 4-methyl-3-[2-[[(1S)-2-methyl-1-phenyl-propyl]amino]ethanoylamino]benzoate

Systemtic Name: methyl 4-methyl-3-[2-[[(1S)-2-methyl-1-phenyl-propyl]amino]ethanoylamino]benzoate Openeye Name: methyl 4-methyl-3-[[2-[[(1S)-2-methyl-1-phenyl-propyl]amino]acetyl]amino]benzoate CAS Name: 4-methyl-3-[[2-[[(1S)-2-methyl-1-phenylpropyl]amino]-1-oxoethyl]amino]benzoic acid methyl ester IUPAC Name: methyl 4-methyl-3-[[2-[[(1S)-2-methyl-1-phenylpropyl]amino]acetyl]amino]benzoate Traditional Name: 4-methyl-3-[[2-[[(1S)-2-methyl-1-phenyl-propyl]amino]acetyl]amino]benzoic acid methyl ester Formula: C21H26N2O3 MolecularWeight: 354.44274

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)C(=O)OC)NC(=O)CNC(C2=CC=CC=C2)C(C)C

Isomeric SMILES

CC1=C(C=C(C=C1)C(=O)OC)NC(=O)CN[C@H](C2=CC=CC=C2)C(C)C

InChI

InChI=1S/C21H26N2O3/c1-14(2)20(16-8-6-5-7-9-16)22-13-19(24)23-18-12-17(21(25)26-4)11-10-15(18)3/h5-12,14,20,22H,13H2,1-4H3,(H,23,24)/t20-/m0/s1