dihydrogen phosphate; 1-(4-methoxyphenyl)-N-[(E)-(1,3,3-trimethyl-5-nitro-indol-1-ium-2-yl)methylideneamino]methanamine

Systemtic Name: dihydrogen phosphate; 1-(4-methoxyphenyl)-N-[(E)-(1,3,3-trimethyl-5-nitro-indol-1-ium-2-yl)methylideneamino]methanamine Openeye Name: dihydrogen phosphate; 1-(4-methoxyphenyl)-N-[(E)-(1,3,3-trimethyl-5-nitro-indol-1-ium-2-yl)methyleneamino]methanamine CAS Name: dihydrogen phosphate; 1-(4-methoxyphenyl)-N-[(E)-(1,3,3-trimethyl-5-nitro-2-indol-1-iumyl)methylideneamino]methanamine IUPAC Name: dihydrogen phosphate; 1-(4-methoxyphenyl)-N-[(E)-(1,3,3-trimethyl-5-nitroindol-1-ium-2-yl)methylideneamino]methanamine Traditional Name: dihydrogen phosphate; p-anisyl-[(E)-(1,3,3-trimethyl-5-nitro-indol-1-ium-2-yl)methyleneamino]amine Formula: C20H25N4O7P MolecularWeight: 464.408861

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Descriptors Computed from Structure

Canonical SMILES:

CC1(C2=C(C=CC(=C2)[N+](=O)[O-])[N+](=C1C=NNCC3=CC=C(C=C3)OC)C)C.OP(=O)(O)[O-]

Isomeric SMILES

CC1(C2=C(C=CC(=C2)[N+](=O)[O-])[N+](=C1/C=N/NCC3=CC=C(C=C3)OC)C)C.OP(=O)(O)[O-]

InChI

InChI=1S/C20H22N4O3.H3O4P/c1-20(2)17-11-15(24(25)26)7-10-18(17)23(3)19(20)13-22-21-12-14-5-8-16(27-4)9-6-14;1-5(2,3)4/h5-11,13H,12H2,1-4H3;(H3,1,2,3,4)