(3-ethoxycarbonyl-1,2-oxazol-5-yl)methyl-[(1R)-1-(4-piperidin-1-ylphenyl)ethyl]azanium

Systemtic Name: (3-ethoxycarbonyl-1,2-oxazol-5-yl)methyl-[(1R)-1-(4-piperidin-1-ylphenyl)ethyl]azanium Openeye Name: (3-ethoxycarbonylisoxazol-5-yl)methyl-[(1R)-1-[4-(1-piperidyl)phenyl]ethyl]ammonium CAS Name: (3-ethoxycarbonyl-5-isoxazolyl)methyl-[(1R)-1-[4-(1-piperidinyl)phenyl]ethyl]ammonium IUPAC Name: (3-ethoxycarbonyl-1,2-oxazol-5-yl)methyl-[(1R)-1-(4-piperidin-1-ylphenyl)ethyl]azanium Traditional Name: (3-carbethoxyisoxazol-5-yl)methyl-[(1R)-1-(4-piperidinophenyl)ethyl]ammonium Formula: C20H28N3O3+ MolecularWeight: 358.45462

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=NOC(=C1)C[NH2+]C(C)C2=CC=C(C=C2)N3CCCCC3

Isomeric SMILES

CCOC(=O)C1=NOC(=C1)C[NH2+][C@H](C)C2=CC=C(C=C2)N3CCCCC3

InChI

InChI=1S/C20H27N3O3/c1-3-25-20(24)19-13-18(26-22-19)14-21-15(2)16-7-9-17(10-8-16)23-11-5-4-6-12-23/h7-10,13,15,21H,3-6,11-12,14H2,1-2H3/p+1/t15-/m1/s1