N-[(Z)-1-[4-methoxy-3-(piperidin-1-ium-1-ylmethyl)phenyl]ethylideneamino]-4,6-dimethyl-pyrimidin-2-amine

Systemtic Name: N-[(Z)-1-[4-methoxy-3-(piperidin-1-ium-1-ylmethyl)phenyl]ethylideneamino]-4,6-dimethyl-pyrimidin-2-amine Openeye Name: N-[(Z)-1-[4-methoxy-3-(piperidin-1-ium-1-ylmethyl)phenyl]ethylideneamino]-4,6-dimethyl-pyrimidin-2-amine CAS Name: N-[(Z)-1-[4-methoxy-3-(1-piperidin-1-iumylmethyl)phenyl]ethylideneamino]-4,6-dimethyl-2-pyrimidinamine IUPAC Name: N-[(Z)-1-[4-methoxy-3-(piperidin-1-ium-1-ylmethyl)phenyl]ethylideneamino]-4,6-dimethylpyrimidin-2-amine Traditional Name: (4,6-dimethylpyrimidin-2-yl)-[(Z)-1-[4-methoxy-3-(piperidin-1-ium-1-ylmethyl)phenyl]ethylideneamino]amine Formula: C21H30N5O+ MolecularWeight: 368.4958

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=NC(=N1)NN=C(C)C2=CC(=C(C=C2)OC)C[NH+]3CCCCC3)C

Isomeric SMILES

CC1=CC(=NC(=N1)N/N=C(/C)\C2=CC(=C(C=C2)OC)C[NH+]3CCCCC3)C

InChI

InChI=1S/C21H29N5O/c1-15-12-16(2)23-21(22-15)25-24-17(3)18-8-9-20(27-4)19(13-18)14-26-10-6-5-7-11-26/h8-9,12-13H,5-7,10-11,14H2,1-4H3,(H,22,23,25)/p+1/b24-17-