1-azanyl-3-(6-chloranylnaphthalen-2-yl)sulfonyl-1-methyl-3-(1-pyridin-4-ylpiperidin-4-yl)piperazin-1-ium-2-one

Systemtic Name: 1-azanyl-3-(6-chloranylnaphthalen-2-yl)sulfonyl-1-methyl-3-(1-pyridin-4-ylpiperidin-4-yl)piperazin-1-ium-2-one Openeye Name: 1-amino-3-[(6-chloro-2-naphthyl)sulfonyl]-1-methyl-3-[1-(4-pyridyl)-4-piperidyl]piperazin-1-ium-2-one CAS Name: 1-amino-3-[(6-chloro-2-naphthalenyl)sulfonyl]-1-methyl-3-(1-pyridin-4-yl-4-piperidinyl)-2-piperazin-1-iumone IUPAC Name: 1-amino-3-(6-chloronaphthalen-2-yl)sulfonyl-1-methyl-3-(1-pyridin-4-ylpiperidin-4-yl)piperazin-1-ium-2-one Traditional Name: 1-amino-3-[(6-chloro-2-naphthyl)sulfonyl]-1-methyl-3-[1-(4-pyridyl)-4-piperidyl]piperazin-1-ium-2-one Formula: C25H29ClN5O3S+ MolecularWeight: 515.04746

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C[N+]1(CCNC(C1=O)(C2CCN(CC2)C3=CC=NC=C3)S(=O)(=O)C4=CC5=C(C=C4)C=C(C=C5)Cl)N

Isomeric SMILES

C[N+]1(CCNC(C1=O)(C2CCN(CC2)C3=CC=NC=C3)S(=O)(=O)C4=CC5=C(C=C4)C=C(C=C5)Cl)N

InChI

InChI=1S/C25H29ClN5O3S/c1-31(27)15-12-29-25(24(31)32,20-8-13-30(14-9-20)22-6-10-28-11-7-22)35(33,34)23-5-3-18-16-21(26)4-2-19(18)17-23/h2-7,10-11,16-17,20,29H,8-9,12-15,27H2,1H3/q+1