[2-methoxy-4-[(3R)-3-(2-phenylethanoylamino)butyl]phenyl] 2-phenylethanoate

Systemtic Name: [2-methoxy-4-[(3R)-3-(2-phenylethanoylamino)butyl]phenyl] 2-phenylethanoate Openeye Name: [2-methoxy-4-[(3R)-3-[(2-phenylacetyl)amino]butyl]phenyl] 2-phenylacetate CAS Name: 2-phenylacetic acid [2-methoxy-4-[(3R)-3-[(1-oxo-2-phenylethyl)amino]butyl]phenyl] ester IUPAC Name: [2-methoxy-4-[(3R)-3-[(2-phenylacetyl)amino]butyl]phenyl] 2-phenylacetate Traditional Name: 2-phenylacetic acid [2-methoxy-4-[(3R)-3-[(2-phenylacetyl)amino]butyl]phenyl] ester Formula: C27H29NO4 MolecularWeight: 431.52346

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Descriptors Computed from Structure

Canonical SMILES:

CC(CCC1=CC(=C(C=C1)OC(=O)CC2=CC=CC=C2)OC)NC(=O)CC3=CC=CC=C3

Isomeric SMILES

C[C@H](CCC1=CC(=C(C=C1)OC(=O)CC2=CC=CC=C2)OC)NC(=O)CC3=CC=CC=C3

InChI

InChI=1S/C27H29NO4/c1-20(28-26(29)18-21-9-5-3-6-10-21)13-14-23-15-16-24(25(17-23)31-2)32-27(30)19-22-11-7-4-8-12-22/h3-12,15-17,20H,13-14,18-19H2,1-2H3,(H,28,29)/t20-/m1/s1