2-[[(2S)-1-ethoxy-1-oxidanylidene-tetradecan-2-yl]amino]-3-phenyl-propanoic acid

Systemtic Name: 2-[[(2S)-1-ethoxy-1-oxidanylidene-tetradecan-2-yl]amino]-3-phenyl-propanoic acid Openeye Name: 2-[[(1S)-1-ethoxycarbonyltridecyl]amino]-3-phenyl-propanoic acid CAS Name: 2-[[(2S)-1-ethoxy-1-oxotetradecan-2-yl]amino]-3-phenylpropanoic acid IUPAC Name: 2-[[(2S)-1-ethoxy-1-oxotetradecan-2-yl]amino]-3-phenylpropanoic acid Traditional Name: 2-[[(1S)-1-carbethoxytridecyl]amino]-3-phenyl-propionic acid Formula: C25H41NO4 MolecularWeight: 419.59734

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCC(C(=O)OCC)NC(CC1=CC=CC=C1)C(=O)O

Isomeric SMILES

CCCCCCCCCCCC[C@@H](C(=O)OCC)NC(CC1=CC=CC=C1)C(=O)O

InChI

InChI=1S/C25H41NO4/c1-3-5-6-7-8-9-10-11-12-16-19-22(25(29)30-4-2)26-23(24(27)28)20-21-17-14-13-15-18-21/h13-15,17-18,22-23,26H,3-12,16,19-20H2,1-2H3,(H,27,28)/t22-,23?/m0/s1