1-[(3S)-3-[(4-fluorophenyl)amino]piperidin-1-yl]-3-(3-methoxyphenyl)propan-1-one

Systemtic Name: 1-[(3S)-3-[(4-fluorophenyl)amino]piperidin-1-yl]-3-(3-methoxyphenyl)propan-1-one Openeye Name: 1-[(3S)-3-(4-fluoroanilino)-1-piperidyl]-3-(3-methoxyphenyl)propan-1-one CAS Name: 1-[(3S)-3-(4-fluoroanilino)-1-piperidinyl]-3-(3-methoxyphenyl)-1-propanone IUPAC Name: 1-[(3S)-3-(4-fluoroanilino)piperidin-1-yl]-3-(3-methoxyphenyl)propan-1-one Traditional Name: 1-[(3S)-3-(4-fluoroanilino)piperidino]-3-(3-methoxyphenyl)propan-1-one Formula: C21H25FN2O2 MolecularWeight: 356.433803

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=CC(=C1)CCC(=O)N2CCCC(C2)NC3=CC=C(C=C3)F

Isomeric SMILES

COC1=CC=CC(=C1)CCC(=O)N2CCC[C@@H](C2)NC3=CC=C(C=C3)F

InChI

InChI=1S/C21H25FN2O2/c1-26-20-6-2-4-16(14-20)7-12-21(25)24-13-3-5-19(15-24)23-18-10-8-17(22)9-11-18/h2,4,6,8-11,14,19,23H,3,5,7,12-13,15H2,1H3/t19-/m0/s1