ethyl 3-azanyl-3-[(2-butylphenyl)methyl]heptanoate

Systemtic Name: ethyl 3-azanyl-3-[(2-butylphenyl)methyl]heptanoate Openeye Name: ethyl 3-amino-3-[(2-butylphenyl)methyl]heptanoate CAS Name: 3-amino-3-[(2-butylphenyl)methyl]heptanoic acid ethyl ester IUPAC Name: ethyl 3-amino-3-[(2-butylphenyl)methyl]heptanoate Traditional Name: 3-amino-3-(2-butylbenzyl)enanthic acid ethyl ester Formula: C20H33NO2 MolecularWeight: 319.48152

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC1=CC=CC=C1CC(CCCC)(CC(=O)OCC)N

Isomeric SMILES

CCCCC1=CC=CC=C1CC(CCCC)(CC(=O)OCC)N

InChI

InChI=1S/C20H33NO2/c1-4-7-11-17-12-9-10-13-18(17)15-20(21,14-8-5-2)16-19(22)23-6-3/h9-10,12-13H,4-8,11,14-16,21H2,1-3H3