2-methylpropyl-[[(E)-2-(2-methylpropyl)-3-(oxan-2-yloxycarbamoyl)-6-phenyl-hex-5-enoyl]amino]carbamic acid

Systemtic Name: 2-methylpropyl-[[(E)-2-(2-methylpropyl)-3-(oxan-2-yloxycarbamoyl)-6-phenyl-hex-5-enoyl]amino]carbamic acid Openeye Name: isobutyl-[[(E)-2-isobutyl-6-phenyl-3-(tetrahydropyran-2-yloxycarbamoyl)hex-5-enoyl]amino]carbamic acid CAS Name: 2-methylpropyl-[[(E)-2-(2-methylpropyl)-3-[(2-oxanyloxyamino)-oxomethyl]-1-oxo-6-phenylhex-5-enyl]amino]carbamic acid IUPAC Name: 2-methylpropyl-[[(E)-2-(2-methylpropyl)-3-(oxan-2-yloxycarbamoyl)-6-phenylhex-5-enoyl]amino]carbamic acid Traditional Name: isobutyl-[[(E)-2-isobutyl-6-phenyl-3-(tetrahydropyran-2-yloxycarbamoyl)hex-5-enoyl]amino]carbamic acid Formula: C27H41N3O6 MolecularWeight: 503.63094

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CC(C(CC=CC1=CC=CC=C1)C(=O)NOC2CCCCO2)C(=O)NN(CC(C)C)C(=O)O

Isomeric SMILES

CC(C)CC(C(C/C=C/C1=CC=CC=C1)C(=O)NOC2CCCCO2)C(=O)NN(CC(C)C)C(=O)O

InChI

InChI=1S/C27H41N3O6/c1-19(2)17-23(25(31)28-30(27(33)34)18-20(3)4)22(14-10-13-21-11-6-5-7-12-21)26(32)29-36-24-15-8-9-16-35-24/h5-7,10-13,19-20,22-24H,8-9,14-18H2,1-4H3,(H,28,31)(H,29,32)(H,33,34)/b13-10+