4-[[4-(2-azanylethyl)phenyl]-ethanoyl-amino]-N-octyl-piperidine-1-carboxamide methanoate

Systemtic Name: 4-[[4-(2-azanylethyl)phenyl]-ethanoyl-amino]-N-octyl-piperidine-1-carboxamide methanoate Openeye Name: 4-[N-acetyl-4-(2-aminoethyl)anilino]-N-octyl-piperidine-1-carboxamide formate CAS Name: 4-[N-acetyl-4-(2-aminoethyl)anilino]-N-octyl-1-piperidinecarboxamide formate IUPAC Name: 4-[N-acetyl-4-(2-aminoethyl)anilino]-N-octylpiperidine-1-carboxamide formate Traditional Name: 4-[N-acetyl-4-(2-aminoethyl)anilino]-N-octyl-piperidine-1-carboxamide formate Formula: C25H41N4O4- MolecularWeight: 461.61744

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCNC(=O)N1CCC(CC1)N(C2=CC=C(C=C2)CCN)C(=O)C.C(=O)[O-]

Isomeric SMILES

CCCCCCCCNC(=O)N1CCC(CC1)N(C2=CC=C(C=C2)CCN)C(=O)C.C(=O)[O-]

InChI

InChI=1S/C24H40N4O2.CH2O2/c1-3-4-5-6-7-8-17-26-24(30)27-18-14-23(15-19-27)28(20(2)29)22-11-9-21(10-12-22)13-16-25;2-1-3/h9-12,23H,3-8,13-19,25H2,1-2H3,(H,26,30);1H,(H,2,3)/p-1