2-azanyl-4-(4-heptoxyphenyl)-2-(hydroxymethyl)butanoic acid

Systemtic Name: 2-azanyl-4-(4-heptoxyphenyl)-2-(hydroxymethyl)butanoic acid Openeye Name: 2-amino-4-(4-heptoxyphenyl)-2-(hydroxymethyl)butanoic acid CAS Name: 2-amino-4-(4-heptoxyphenyl)-2-(hydroxymethyl)butanoic acid IUPAC Name: 2-amino-4-(4-heptoxyphenyl)-2-(hydroxymethyl)butanoic acid Traditional Name: 2-amino-4-(4-heptoxyphenyl)-2-methylol-butyric acid Formula: C18H29NO4 MolecularWeight: 323.42716

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCOC1=CC=C(C=C1)CCC(CO)(C(=O)O)N

Isomeric SMILES

CCCCCCCOC1=CC=C(C=C1)CCC(CO)(C(=O)O)N

InChI

InChI=1S/C18H29NO4/c1-2-3-4-5-6-13-23-16-9-7-15(8-10-16)11-12-18(19,14-20)17(21)22/h7-10,20H,2-6,11-14,19H2,1H3,(H,21,22)