4-[(2E)-2-[3-(phenylmethyl)-1,3-benzothiazol-2-ylidene]ethylidene]morpholin-4-ium

Systemtic Name: 4-[(2E)-2-[3-(phenylmethyl)-1,3-benzothiazol-2-ylidene]ethylidene]morpholin-4-ium Openeye Name: 4-[(2E)-2-(3-benzyl-1,3-benzothiazol-2-ylidene)ethylidene]morpholin-4-ium CAS Name: 4-[(2E)-2-[3-(phenylmethyl)-1,3-benzothiazol-2-ylidene]ethylidene]morpholin-4-ium IUPAC Name: 4-[(2E)-2-(3-benzyl-1,3-benzothiazol-2-ylidene)ethylidene]morpholin-4-ium Traditional Name: 4-[(2E)-2-(3-benzyl-1,3-benzothiazol-2-ylidene)ethylidene]morpholin-4-ium Formula: C20H21N2OS+ MolecularWeight: 337.45854

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Descriptors Computed from Structure

Canonical SMILES:

C1COCC[N+]1=CC=C2N(C3=CC=CC=C3S2)CC4=CC=CC=C4

Isomeric SMILES

C1COCC[N+]1=C/C=C/2\N(C3=CC=CC=C3S2)CC4=CC=CC=C4

InChI

InChI=1S/C20H21N2OS/c1-2-6-17(7-3-1)16-22-18-8-4-5-9-19(18)24-20(22)10-11-21-12-14-23-15-13-21/h1-11H,12-16H2/q+1