[(2S)-2-(dimethylamino)-4-methyl-pentyl] 4-azanyl-3-butoxy-benzoate

Systemtic Name: [(2S)-2-(dimethylamino)-4-methyl-pentyl] 4-azanyl-3-butoxy-benzoate Openeye Name: [(2S)-2-(dimethylamino)-4-methyl-pentyl] 4-amino-3-butoxy-benzoate CAS Name: 4-amino-3-butoxybenzoic acid [(2S)-2-(dimethylamino)-4-methylpentyl] ester IUPAC Name: [(2S)-2-(dimethylamino)-4-methylpentyl] 4-amino-3-butoxybenzoate Traditional Name: 4-amino-3-butoxy-benzoic acid [(2S)-2-(dimethylamino)-4-methyl-pentyl] ester Formula: C19H32N2O3 MolecularWeight: 336.46898

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Descriptors Computed from Structure

Canonical SMILES:

CCCCOC1=C(C=CC(=C1)C(=O)OCC(CC(C)C)N(C)C)N

Isomeric SMILES

CCCCOC1=C(C=CC(=C1)C(=O)OC[C@H](CC(C)C)N(C)C)N

InChI

InChI=1S/C19H32N2O3/c1-6-7-10-23-18-12-15(8-9-17(18)20)19(22)24-13-16(21(4)5)11-14(2)3/h8-9,12,14,16H,6-7,10-11,13,20H2,1-5H3/t16-/m0/s1