methyl (3S,4S)-4-(9H-fluoren-9-ylmethoxycarbonylamino)-6-methyl-2-methylidene-3-oxidanyl-heptanoate

Systemtic Name: methyl (3S,4S)-4-(9H-fluoren-9-ylmethoxycarbonylamino)-6-methyl-2-methylidene-3-oxidanyl-heptanoate Openeye Name: methyl (3S,4S)-4-(9H-fluoren-9-ylmethoxycarbonylamino)-3-hydroxy-6-methyl-2-methylene-heptanoate CAS Name: (3S,4S)-4-[[9H-fluoren-9-ylmethoxy(oxo)methyl]amino]-3-hydroxy-6-methyl-2-methyleneheptanoic acid methyl ester IUPAC Name: methyl (3S,4S)-4-(9H-fluoren-9-ylmethoxycarbonylamino)-3-hydroxy-6-methyl-2-methylideneheptanoate Traditional Name: 2-[(1S,2S)-2-(9H-fluoren-9-ylmethoxycarbonylamino)-1-hydroxy-4-methyl-pentyl]acrylic acid methyl ester Formula: C25H29NO5 MolecularWeight: 423.50146

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CC(C(C(=C)C(=O)OC)O)NC(=O)OCC1C2=CC=CC=C2C3=CC=CC=C13

Isomeric SMILES

CC(C)C[C@@H]([C@H](C(=C)C(=O)OC)O)NC(=O)OCC1C2=CC=CC=C2C3=CC=CC=C13

InChI

InChI=1S/C25H29NO5/c1-15(2)13-22(23(27)16(3)24(28)30-4)26-25(29)31-14-21-19-11-7-5-9-17(19)18-10-6-8-12-20(18)21/h5-12,15,21-23,27H,3,13-14H2,1-2,4H3,(H,26,29)/t22-,23-/m0/s1