(phenylmethyl) 3-methyl-2-[2-[(1-phenyl-9H-fluoren-9-yl)amino]pent-4-enoylamino]butanoate

Systemtic Name: (phenylmethyl) 3-methyl-2-[2-[(1-phenyl-9H-fluoren-9-yl)amino]pent-4-enoylamino]butanoate Openeye Name: benzyl 3-methyl-2-[2-[(1-phenyl-9H-fluoren-9-yl)amino]pent-4-enoylamino]butanoate CAS Name: 3-methyl-2-[[1-oxo-2-[(1-phenyl-9H-fluoren-9-yl)amino]pent-4-enyl]amino]butanoic acid (phenylmethyl) ester IUPAC Name: benzyl 3-methyl-2-[2-[(1-phenyl-9H-fluoren-9-yl)amino]pent-4-enoylamino]butanoate Traditional Name: 3-methyl-2-[2-[(1-phenyl-9H-fluoren-9-yl)amino]pent-4-enoylamino]butyric acid benzyl ester Formula: C36H36N2O3 MolecularWeight: 544.68264

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C(C(=O)OCC1=CC=CC=C1)NC(=O)C(CC=C)NC2C3=CC=CC=C3C4=CC=CC(=C24)C5=CC=CC=C5

Isomeric SMILES

CC(C)C(C(=O)OCC1=CC=CC=C1)NC(=O)C(CC=C)NC2C3=CC=CC=C3C4=CC=CC(=C24)C5=CC=CC=C5

InChI

InChI=1S/C36H36N2O3/c1-4-14-31(35(39)38-33(24(2)3)36(40)41-23-25-15-7-5-8-16-25)37-34-30-20-12-11-19-28(30)29-22-13-21-27(32(29)34)26-17-9-6-10-18-26/h4-13,15-22,24,31,33-34,37H,1,14,23H2,2-3H3,(H,38,39)