1H-indol-5-yl N-butyl-N-[1-(3-fluoranylpyridin-4-yl)propylamino]carbamate hydrochloride

Systemtic Name: 1H-indol-5-yl N-butyl-N-[1-(3-fluoranylpyridin-4-yl)propylamino]carbamate hydrochloride Openeye Name: 1H-indol-5-yl N-butyl-N-[1-(3-fluoro-4-pyridyl)propylamino]carbamate hydrochloride CAS Name: N-butyl-N-[1-(3-fluoro-4-pyridinyl)propylamino]carbamic acid 1H-indol-5-yl ester hydrochloride IUPAC Name: 1H-indol-5-yl N-butyl-N-[1-(3-fluoropyridin-4-yl)propylamino]carbamate hydrochloride Traditional Name: N-butyl-N-[1-(3-fluoro-4-pyridyl)propylamino]carbamic acid 1H-indol-5-yl ester hydrochloride Formula: C21H26ClFN4O2 MolecularWeight: 420.908143

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Descriptors Computed from Structure

Canonical SMILES:

CCCCN(C(=O)OC1=CC2=C(C=C1)NC=C2)NC(CC)C3=C(C=NC=C3)F.Cl

Isomeric SMILES

CCCCN(C(=O)OC1=CC2=C(C=C1)NC=C2)NC(CC)C3=C(C=NC=C3)F.Cl

InChI

InChI=1S/C21H25FN4O2.ClH/c1-3-5-12-26(25-19(4-2)17-9-10-23-14-18(17)22)21(27)28-16-6-7-20-15(13-16)8-11-24-20;/h6-11,13-14,19,24-25H,3-5,12H2,1-2H3;1H