1-[4-[[4-(2-azanylethyl)phenyl]amino]piperidin-1-yl]hexan-1-one; methanoic acid

Systemtic Name: 1-[4-[[4-(2-azanylethyl)phenyl]amino]piperidin-1-yl]hexan-1-one; methanoic acid Openeye Name: 1-[4-[4-(2-aminoethyl)anilino]-1-piperidyl]hexan-1-one; formic acid CAS Name: 1-[4-[4-(2-aminoethyl)anilino]-1-piperidinyl]-1-hexanone; formic acid IUPAC Name: 1-[4-[4-(2-aminoethyl)anilino]piperidin-1-yl]hexan-1-one; formic acid Traditional Name: 1-[4-[4-(2-aminoethyl)anilino]piperidino]hexan-1-one; formic acid Formula: C20H33N3O3 MolecularWeight: 363.49432

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCC(=O)N1CCC(CC1)NC2=CC=C(C=C2)CCN.C(=O)O

Isomeric SMILES

CCCCCC(=O)N1CCC(CC1)NC2=CC=C(C=C2)CCN.C(=O)O

InChI

InChI=1S/C19H31N3O.CH2O2/c1-2-3-4-5-19(23)22-14-11-18(12-15-22)21-17-8-6-16(7-9-17)10-13-20;2-1-3/h6-9,18,21H,2-5,10-15,20H2,1H3;1H,(H,2,3)