7-[(4-butoxyphenyl)methylamino]-7-oxidanylidene-heptanoic acid

Systemtic Name: 7-[(4-butoxyphenyl)methylamino]-7-oxidanylidene-heptanoic acid Openeye Name: 7-[(4-butoxyphenyl)methylamino]-7-oxo-heptanoic acid CAS Name: 7-[(4-butoxyphenyl)methylamino]-7-oxoheptanoic acid IUPAC Name: 7-[(4-butoxyphenyl)methylamino]-7-oxoheptanoic acid Traditional Name: 7-[(4-butoxybenzyl)amino]-7-keto-enanthic acid Formula: C18H27NO4 MolecularWeight: 321.41128

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Descriptors Computed from Structure

Canonical SMILES:

CCCCOC1=CC=C(C=C1)CNC(=O)CCCCCC(=O)O

Isomeric SMILES

CCCCOC1=CC=C(C=C1)CNC(=O)CCCCCC(=O)O

InChI

InChI=1S/C18H27NO4/c1-2-3-13-23-16-11-9-15(10-12-16)14-19-17(20)7-5-4-6-8-18(21)22/h9-12H,2-8,13-14H2,1H3,(H,19,20)(H,21,22)