4-(heptylamino)-2-methyl-2-phenoxy-pentanoic acid

Systemtic Name: 4-(heptylamino)-2-methyl-2-phenoxy-pentanoic acid Openeye Name: 4-(heptylamino)-2-methyl-2-phenoxy-pentanoic acid CAS Name: 4-(heptylamino)-2-methyl-2-phenoxypentanoic acid IUPAC Name: 4-(heptylamino)-2-methyl-2-phenoxypentanoic acid Traditional Name: 4-(heptylamino)-2-methyl-2-phenoxy-valeric acid Formula: C19H31NO3 MolecularWeight: 321.45434

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCNC(C)CC(C)(C(=O)O)OC1=CC=CC=C1

Isomeric SMILES

CCCCCCCNC(C)CC(C)(C(=O)O)OC1=CC=CC=C1

InChI

InChI=1S/C19H31NO3/c1-4-5-6-7-11-14-20-16(2)15-19(3,18(21)22)23-17-12-9-8-10-13-17/h8-10,12-13,16,20H,4-7,11,14-15H2,1-3H3,(H,21,22)