[1-[4-(2-morpholin-4-ium-4-ylethylcarbamoyl)phenyl]piperidin-4-yl]-(quinolin-6-ylmethyl)azanium

Systemtic Name: [1-[4-(2-morpholin-4-ium-4-ylethylcarbamoyl)phenyl]piperidin-4-yl]-(quinolin-6-ylmethyl)azanium Openeye Name: [1-[4-(2-morpholin-4-ium-4-ylethylcarbamoyl)phenyl]-4-piperidyl]-(6-quinolylmethyl)ammonium CAS Name: [1-[4-[[2-(4-morpholin-4-iumyl)ethylamino]-oxomethyl]phenyl]-4-piperidinyl]-(6-quinolinylmethyl)ammonium IUPAC Name: [1-[4-(2-morpholin-4-ium-4-ylethylcarbamoyl)phenyl]piperidin-4-yl]-(quinolin-6-ylmethyl)azanium Traditional Name: [1-[4-(2-morpholin-4-ium-4-ylethylcarbamoyl)phenyl]-4-piperidyl]-(6-quinolylmethyl)ammonium Formula: C28H37N5O2+2 MolecularWeight: 475.62568

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCC1[NH2+]CC2=CC3=C(C=C2)N=CC=C3)C4=CC=C(C=C4)C(=O)NCC[NH+]5CCOCC5

Isomeric SMILES

C1CN(CCC1[NH2+]CC2=CC3=C(C=C2)N=CC=C3)C4=CC=C(C=C4)C(=O)NCC[NH+]5CCOCC5

InChI

InChI=1S/C28H35N5O2/c34-28(30-12-15-32-16-18-35-19-17-32)23-4-6-26(7-5-23)33-13-9-25(10-14-33)31-21-22-3-8-27-24(20-22)2-1-11-29-27/h1-8,11,20,25,31H,9-10,12-19,21H2,(H,30,34)/p+2