(Z,4S)-6-methyl-4-[[(2R)-3-methyl-1-phenylmethoxy-butan-2-yl]-oxidanyl-amino]hept-2-enoic acid

Systemtic Name: (Z,4S)-6-methyl-4-[[(2R)-3-methyl-1-phenylmethoxy-butan-2-yl]-oxidanyl-amino]hept-2-enoic acid Openeye Name: (Z,4S)-4-[[(1R)-1-(benzyloxymethyl)-2-methyl-propyl]-hydroxy-amino]-6-methyl-hept-2-enoic acid CAS Name: (Z,4S)-4-[hydroxy-[(2R)-3-methyl-1-phenylmethoxybutan-2-yl]amino]-6-methyl-2-heptenoic acid IUPAC Name: (Z,4S)-4-[hydroxy-[(2R)-3-methyl-1-phenylmethoxybutan-2-yl]amino]-6-methylhept-2-enoic acid Traditional Name: (Z,4S)-4-[[(1R)-1-(benzoxymethyl)-2-methyl-propyl]-hydroxy-amino]-6-methyl-hept-2-enoic acid Formula: C20H31NO4 MolecularWeight: 349.46444

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CC(C=CC(=O)O)N(C(COCC1=CC=CC=C1)C(C)C)O

Isomeric SMILES

CC(C)C[C@@H](/C=C\C(=O)O)N([C@@H](COCC1=CC=CC=C1)C(C)C)O

InChI

InChI=1S/C20H31NO4/c1-15(2)12-18(10-11-20(22)23)21(24)19(16(3)4)14-25-13-17-8-6-5-7-9-17/h5-11,15-16,18-19,24H,12-14H2,1-4H3,(H,22,23)/b11-10-/t18-,19+/m1/s1