ethyl (E,4S)-4-(9H-fluoren-9-ylmethoxycarbonylamino)-7-(methylamino)-7-oxidanylidene-hept-2-enoate

Systemtic Name: ethyl (E,4S)-4-(9H-fluoren-9-ylmethoxycarbonylamino)-7-(methylamino)-7-oxidanylidene-hept-2-enoate Openeye Name: ethyl (E,4S)-4-(9H-fluoren-9-ylmethoxycarbonylamino)-7-(methylamino)-7-oxo-hept-2-enoate CAS Name: (E,4S)-4-[[9H-fluoren-9-ylmethoxy(oxo)methyl]amino]-7-(methylamino)-7-oxo-2-heptenoic acid ethyl ester IUPAC Name: ethyl (E,4S)-4-(9H-fluoren-9-ylmethoxycarbonylamino)-7-(methylamino)-7-oxohept-2-enoate Traditional Name: (E,4S)-4-(9H-fluoren-9-ylmethoxycarbonylamino)-7-keto-7-(methylamino)hept-2-enoic acid ethyl ester Formula: C25H28N2O5 MolecularWeight: 436.50022

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C=CC(CCC(=O)NC)NC(=O)OCC1C2=CC=CC=C2C3=CC=CC=C13

Isomeric SMILES

CCOC(=O)/C=C/[C@H](CCC(=O)NC)NC(=O)OCC1C2=CC=CC=C2C3=CC=CC=C13

InChI

InChI=1S/C25H28N2O5/c1-3-31-24(29)15-13-17(12-14-23(28)26-2)27-25(30)32-16-22-20-10-6-4-8-18(20)19-9-5-7-11-21(19)22/h4-11,13,15,17,22H,3,12,14,16H2,1-2H3,(H,26,28)(H,27,30)/b15-13+/t17-/m0/s1