3-[2-methoxy-4-[(3S)-3-methylpiperidin-1-yl]carbonyl-phenoxy]propylazanium

Systemtic Name: 3-[2-methoxy-4-[(3S)-3-methylpiperidin-1-yl]carbonyl-phenoxy]propylazanium Openeye Name: 3-[2-methoxy-4-[(3S)-3-methylpiperidine-1-carbonyl]phenoxy]propylammonium CAS Name: 3-[2-methoxy-4-[[(3S)-3-methyl-1-piperidinyl]-oxomethyl]phenoxy]propylammonium IUPAC Name: 3-[2-methoxy-4-[(3S)-3-methylpiperidine-1-carbonyl]phenoxy]propylazanium Traditional Name: 3-[2-methoxy-4-[(3S)-3-methylpiperidine-1-carbonyl]phenoxy]propylammonium Formula: C17H27N2O3+ MolecularWeight: 307.40788

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Descriptors Computed from Structure

Canonical SMILES:

CC1CCCN(C1)C(=O)C2=CC(=C(C=C2)OCCC[NH3+])OC

Isomeric SMILES

C[C@H]1CCCN(C1)C(=O)C2=CC(=C(C=C2)OCCC[NH3+])OC

InChI

InChI=1S/C17H26N2O3/c1-13-5-3-9-19(12-13)17(20)14-6-7-15(16(11-14)21-2)22-10-4-8-18/h6-7,11,13H,3-5,8-10,12,18H2,1-2H3/p+1/t13-/m0/s1