[(2S)-3-methyl-2-piperidin-1-yl-butyl] 4-azanyl-3-butoxy-benzoate

Systemtic Name: [(2S)-3-methyl-2-piperidin-1-yl-butyl] 4-azanyl-3-butoxy-benzoate Openeye Name: [(2S)-3-methyl-2-(1-piperidyl)butyl] 4-amino-3-butoxy-benzoate CAS Name: 4-amino-3-butoxybenzoic acid [(2S)-3-methyl-2-(1-piperidinyl)butyl] ester IUPAC Name: [(2S)-3-methyl-2-piperidin-1-ylbutyl] 4-amino-3-butoxybenzoate Traditional Name: 4-amino-3-butoxy-benzoic acid [(2S)-3-methyl-2-piperidino-butyl] ester Formula: C21H34N2O3 MolecularWeight: 362.50626

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Descriptors Computed from Structure

Canonical SMILES:

CCCCOC1=C(C=CC(=C1)C(=O)OCC(C(C)C)N2CCCCC2)N

Isomeric SMILES

CCCCOC1=C(C=CC(=C1)C(=O)OC[C@H](C(C)C)N2CCCCC2)N

InChI

InChI=1S/C21H34N2O3/c1-4-5-13-25-20-14-17(9-10-18(20)22)21(24)26-15-19(16(2)3)23-11-7-6-8-12-23/h9-10,14,16,19H,4-8,11-13,15,22H2,1-3H3/t19-/m1/s1