2-methylpropyl 4-[[bis(2-oxidanylpropyl)amino]methyl]benzoate

Systemtic Name: 2-methylpropyl 4-[[bis(2-oxidanylpropyl)amino]methyl]benzoate Openeye Name: isobutyl 4-[[bis(2-hydroxypropyl)amino]methyl]benzoate CAS Name: 4-[[bis(2-hydroxypropyl)amino]methyl]benzoic acid 2-methylpropyl ester IUPAC Name: 2-methylpropyl 4-[[bis(2-hydroxypropyl)amino]methyl]benzoate Traditional Name: 4-[[bis(2-hydroxypropyl)amino]methyl]benzoic acid isobutyl ester Formula: C18H29NO4 MolecularWeight: 323.42716

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)COC(=O)C1=CC=C(C=C1)CN(CC(C)O)CC(C)O

Isomeric SMILES

CC(C)COC(=O)C1=CC=C(C=C1)CN(CC(C)O)CC(C)O

InChI

InChI=1S/C18H29NO4/c1-13(2)12-23-18(22)17-7-5-16(6-8-17)11-19(9-14(3)20)10-15(4)21/h5-8,13-15,20-21H,9-12H2,1-4H3