methyl 4-[(E,1R,4R)-4-methyl-5-(naphthalen-2-ylamino)-5-oxidanylidene-2-phenyl-1-(phenylmethoxycarbonylamino)pent-2-enyl]benzoate

Systemtic Name: methyl 4-[(E,1R,4R)-4-methyl-5-(naphthalen-2-ylamino)-5-oxidanylidene-2-phenyl-1-(phenylmethoxycarbonylamino)pent-2-enyl]benzoate Openeye Name: methyl 4-[(E,1R,4R)-1-(benzyloxycarbonylamino)-4-methyl-5-(2-naphthylamino)-5-oxo-2-phenyl-pent-2-enyl]benzoate CAS Name: 4-[(E,1R,4R)-4-methyl-5-(2-naphthalenylamino)-5-oxo-2-phenyl-1-(phenylmethoxycarbonylamino)pent-2-enyl]benzoic acid methyl ester IUPAC Name: methyl 4-[(E,1R,4R)-4-methyl-5-(naphthalen-2-ylamino)-5-oxo-2-phenyl-1-(phenylmethoxycarbonylamino)pent-2-enyl]benzoate Traditional Name: 4-[(E,1R,4R)-1-(benzyloxycarbonylamino)-5-keto-4-methyl-5-(2-naphthylamino)-2-phenyl-pent-2-enyl]benzoic acid methyl ester Formula: C38H34N2O5 MolecularWeight: 598.68696

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Descriptors Computed from Structure

Canonical SMILES:

CC(C=C(C1=CC=CC=C1)C(C2=CC=C(C=C2)C(=O)OC)NC(=O)OCC3=CC=CC=C3)C(=O)NC4=CC5=CC=CC=C5C=C4

Isomeric SMILES

C[C@H](/C=C(\C1=CC=CC=C1)/[C@@H](C2=CC=C(C=C2)C(=O)OC)NC(=O)OCC3=CC=CC=C3)C(=O)NC4=CC5=CC=CC=C5C=C4

InChI

InChI=1S/C38H34N2O5/c1-26(36(41)39-33-22-21-28-13-9-10-16-32(28)24-33)23-34(29-14-7-4-8-15-29)35(30-17-19-31(20-18-30)37(42)44-2)40-38(43)45-25-27-11-5-3-6-12-27/h3-24,26,35H,25H2,1-2H3,(H,39,41)(H,40,43)/b34-23+/t26-,35-/m1/s1