4-ethoxy-N-[[1-(phenylmethyl)piperidin-1-ium-4-ylidene]amino]benzenesulfonamide

Systemtic Name: 4-ethoxy-N-[[1-(phenylmethyl)piperidin-1-ium-4-ylidene]amino]benzenesulfonamide Openeye Name: N-[(1-benzylpiperidin-1-ium-4-ylidene)amino]-4-ethoxy-benzenesulfonamide CAS Name: 4-ethoxy-N-[[1-(phenylmethyl)-4-piperidin-1-iumylidene]amino]benzenesulfonamide IUPAC Name: N-[(1-benzylpiperidin-1-ium-4-ylidene)amino]-4-ethoxybenzenesulfonamide Traditional Name: N-[(1-benzylpiperidin-1-ium-4-ylidene)amino]-4-ethoxy-benzenesulfonamide Formula: C20H26N3O3S+ MolecularWeight: 388.50374

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=CC=C(C=C1)S(=O)(=O)NN=C2CC[NH+](CC2)CC3=CC=CC=C3

Isomeric SMILES

CCOC1=CC=C(C=C1)S(=O)(=O)NN=C2CC[NH+](CC2)CC3=CC=CC=C3

InChI

InChI=1S/C20H25N3O3S/c1-2-26-19-8-10-20(11-9-19)27(24,25)22-21-18-12-14-23(15-13-18)16-17-6-4-3-5-7-17/h3-11,22H,2,12-16H2,1H3/p+1