2-[4-[2-oxidanyl-3-(4-phenylbutan-2-ylamino)propoxy]phenyl]ethanamide; 2-phenylethanoic acid

Systemtic Name: 2-[4-[2-oxidanyl-3-(4-phenylbutan-2-ylamino)propoxy]phenyl]ethanamide; 2-phenylethanoic acid Openeye Name: 2-[4-[2-hydroxy-3-[(1-methyl-3-phenyl-propyl)amino]propoxy]phenyl]acetamide; 2-phenylacetic acid CAS Name: 2-[4-[2-hydroxy-3-(4-phenylbutan-2-ylamino)propoxy]phenyl]acetamide; 2-phenylacetic acid IUPAC Name: 2-[4-[2-hydroxy-3-(4-phenylbutan-2-ylamino)propoxy]phenyl]acetamide; 2-phenylacetic acid Traditional Name: 2-[4-[2-hydroxy-3-[(1-methyl-3-phenyl-propyl)amino]propoxy]phenyl]acetamide; 2-phenylacetic acid Formula: C37H44N2O7 MolecularWeight: 628.75446

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Descriptors Computed from Structure

Canonical SMILES:

CC(CCC1=CC=CC=C1)NCC(COC2=CC=C(C=C2)CC(=O)N)O.C1=CC=C(C=C1)CC(=O)O.C1=CC=C(C=C1)CC(=O)O

Isomeric SMILES

CC(CCC1=CC=CC=C1)NCC(COC2=CC=C(C=C2)CC(=O)N)O.C1=CC=C(C=C1)CC(=O)O.C1=CC=C(C=C1)CC(=O)O

InChI

InChI=1S/C21H28N2O3.2C8H8O2/c1-16(7-8-17-5-3-2-4-6-17)23-14-19(24)15-26-20-11-9-18(10-12-20)13-21(22)25;2*9-8(10)6-7-4-2-1-3-5-7/h2-6,9-12,16,19,23-24H,7-8,13-15H2,1H3,(H2,22,25);2*1-5H,6H2,(H,9,10)