sodium 5-azanylhexanoyl 3,4,5-trimethoxybenzoate

Systemtic Name: sodium 5-azanylhexanoyl 3,4,5-trimethoxybenzoate Openeye Name: sodium 5-aminohexanoyl 3,4,5-trimethoxybenzoate CAS Name: sodium 3,4,5-trimethoxybenzoic acid (5-amino-1-oxohexyl) ester IUPAC Name: sodium 5-aminohexanoyl 3,4,5-trimethoxybenzoate Traditional Name: sodium 3,4,5-trimethoxybenzoic acid 5-aminohexanoyl ester Formula: C16H23NNaO6+ MolecularWeight: 348.34669

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Descriptors Computed from Structure

Canonical SMILES:

CC(CCCC(=O)OC(=O)C1=CC(=C(C(=C1)OC)OC)OC)N.[Na+]

Isomeric SMILES

CC(CCCC(=O)OC(=O)C1=CC(=C(C(=C1)OC)OC)OC)N.[Na+]

InChI

InChI=1S/C16H23NO6.Na/c1-10(17)6-5-7-14(18)23-16(19)11-8-12(20-2)15(22-4)13(9-11)21-3;/h8-10H,5-7,17H2,1-4H3;/q;+1