2-[[(2S)-2-[(2-methylpropan-2-yl)oxycarbonylamino]-3-phenyl-propanoyl]amino]pent-4-enoic acid

Systemtic Name: 2-[[(2S)-2-[(2-methylpropan-2-yl)oxycarbonylamino]-3-phenyl-propanoyl]amino]pent-4-enoic acid Openeye Name: 2-[[(2S)-2-(tert-butoxycarbonylamino)-3-phenyl-propanoyl]amino]pent-4-enoic acid CAS Name: 2-[[(2S)-2-[[(2-methylpropan-2-yl)oxy-oxomethyl]amino]-1-oxo-3-phenylpropyl]amino]-4-pentenoic acid IUPAC Name: 2-[[(2S)-2-[(2-methylpropan-2-yl)oxycarbonylamino]-3-phenylpropanoyl]amino]pent-4-enoic acid Traditional Name: 2-[[(2S)-2-(tert-butoxycarbonylamino)-3-phenyl-propanoyl]amino]pent-4-enoic acid Formula: C19H26N2O5 MolecularWeight: 362.42014

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C19H26N2O5/c1-5-9-14(17(23)24)20-16(22)15(12-13-10-7-6-8-11-13)21-18(25)26-19(2,3)4/h5-8,10-11,14-15H,1,9,12H2,2-4H3,(H,20,22)(H,21,25)(H,23,24)/t14?,15-/m0/s1