pentadecyl (2S)-2-[(2-bromophenyl)carbonylamino]propanoate

Systemtic Name: pentadecyl (2S)-2-[(2-bromophenyl)carbonylamino]propanoate Openeye Name: pentadecyl (2S)-2-[(2-bromobenzoyl)amino]propanoate CAS Name: (2S)-2-[[(2-bromophenyl)-oxomethyl]amino]propanoic acid pentadecyl ester IUPAC Name: pentadecyl (2S)-2-[(2-bromobenzoyl)amino]propanoate Traditional Name: (2S)-2-[(2-bromobenzoyl)amino]propionic acid pentadecyl ester Formula: C25H40BrNO3 MolecularWeight: 482.494

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCCCCOC(=O)C(C)NC(=O)C1=CC=CC=C1Br

Isomeric SMILES

CCCCCCCCCCCCCCCOC(=O)[C@H](C)NC(=O)C1=CC=CC=C1Br

InChI

InChI=1S/C25H40BrNO3/c1-3-4-5-6-7-8-9-10-11-12-13-14-17-20-30-25(29)21(2)27-24(28)22-18-15-16-19-23(22)26/h15-16,18-19,21H,3-14,17,20H2,1-2H3,(H,27,28)/t21-/m0/s1