2-[[2-(9H-fluoren-9-ylmethoxycarbonylamino)-4-methyl-pentanoyl]amino]-3-(4-prop-2-enoxyphenyl)propanoic acid

Systemtic Name: 2-[[2-(9H-fluoren-9-ylmethoxycarbonylamino)-4-methyl-pentanoyl]amino]-3-(4-prop-2-enoxyphenyl)propanoic acid Openeye Name: 3-(4-allyloxyphenyl)-2-[[2-(9H-fluoren-9-ylmethoxycarbonylamino)-4-methyl-pentanoyl]amino]propanoic acid CAS Name: 2-[[2-[[9H-fluoren-9-ylmethoxy(oxo)methyl]amino]-4-methyl-1-oxopentyl]amino]-3-(4-prop-2-enoxyphenyl)propanoic acid IUPAC Name: 2-[[2-(9H-fluoren-9-ylmethoxycarbonylamino)-4-methylpentanoyl]amino]-3-(4-prop-2-enoxyphenyl)propanoic acid Traditional Name: 3-(4-allyloxyphenyl)-2-[[2-(9H-fluoren-9-ylmethoxycarbonylamino)-4-methyl-pentanoyl]amino]propionic acid Formula: C33H36N2O6 MolecularWeight: 556.64874

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CC(C(=O)NC(CC1=CC=C(C=C1)OCC=C)C(=O)O)NC(=O)OCC2C3=CC=CC=C3C4=CC=CC=C24

Isomeric SMILES

CC(C)CC(C(=O)NC(CC1=CC=C(C=C1)OCC=C)C(=O)O)NC(=O)OCC2C3=CC=CC=C3C4=CC=CC=C24

InChI

InChI=1S/C33H36N2O6/c1-4-17-40-23-15-13-22(14-16-23)19-30(32(37)38)34-31(36)29(18-21(2)3)35-33(39)41-20-28-26-11-7-5-9-24(26)25-10-6-8-12-27(25)28/h4-16,21,28-30H,1,17-20H2,2-3H3,(H,34,36)(H,35,39)(H,37,38)