2-[3-(4-methanoylpiperazin-1-yl)sulfonyl-4-methoxy-phenyl]ethylazanium

Systemtic Name: 2-[3-(4-methanoylpiperazin-1-yl)sulfonyl-4-methoxy-phenyl]ethylazanium Openeye Name: 2-[3-(4-formylpiperazin-1-yl)sulfonyl-4-methoxy-phenyl]ethylammonium CAS Name: 2-[3-[(4-formyl-1-piperazinyl)sulfonyl]-4-methoxyphenyl]ethylammonium IUPAC Name: 2-[3-(4-formylpiperazin-1-yl)sulfonyl-4-methoxyphenyl]ethylazanium Traditional Name: 2-[3-(4-formylpiperazino)sulfonyl-4-methoxy-phenyl]ethylammonium Formula: C14H22N3O4S+ MolecularWeight: 328.40718

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)CC[NH3+])S(=O)(=O)N2CCN(CC2)C=O

Isomeric SMILES

COC1=C(C=C(C=C1)CC[NH3+])S(=O)(=O)N2CCN(CC2)C=O

InChI

InChI=1S/C14H21N3O4S/c1-21-13-3-2-12(4-5-15)10-14(13)22(19,20)17-8-6-16(11-18)7-9-17/h2-3,10-11H,4-9,15H2,1H3/p+1