(E,4S)-4-[bis(phenylmethyl)amino]-6-methyl-hept-2-enoic acid

Systemtic Name: (E,4S)-4-[bis(phenylmethyl)amino]-6-methyl-hept-2-enoic acid Openeye Name: (E,4S)-4-(dibenzylamino)-6-methyl-hept-2-enoic acid CAS Name: (E,4S)-4-[bis(phenylmethyl)amino]-6-methyl-2-heptenoic acid IUPAC Name: (E,4S)-4-(dibenzylamino)-6-methylhept-2-enoic acid Traditional Name: (E,4S)-4-(dibenzylamino)-6-methyl-hept-2-enoic acid Formula: C22H27NO2 MolecularWeight: 337.45528

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CC(C=CC(=O)O)N(CC1=CC=CC=C1)CC2=CC=CC=C2

Isomeric SMILES

CC(C)C[C@@H](/C=C/C(=O)O)N(CC1=CC=CC=C1)CC2=CC=CC=C2

InChI

InChI=1S/C22H27NO2/c1-18(2)15-21(13-14-22(24)25)23(16-19-9-5-3-6-10-19)17-20-11-7-4-8-12-20/h3-14,18,21H,15-17H2,1-2H3,(H,24,25)/b14-13+/t21-/m1/s1