aniline; 3-[(E)-2-phenylethenyl]-6H-indazol-6-ide; yttrium(3+)

Systemtic Name: aniline; 3-[(E)-2-phenylethenyl]-6H-indazol-6-ide; yttrium(3+) Openeye Name: aniline; 3-[(E)-styryl]-6H-indazol-6-ide; yttrium(3+) CAS Name: aniline; 3-[(E)-2-phenylethenyl]-6H-indazol-6-ide; yttrium(3+) IUPAC Name: aniline; 3-[(E)-2-phenylethenyl]-6H-indazol-6-ide; yttrium(3+) Traditional Name: phenylamine; 3-[(E)-styryl]-6H-indazol-6-ide; yttrium(3+) Formula: C21H17N3Y+ MolecularWeight: 400.28563

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Descriptors Computed from Structure

Canonical SMILES:

[CH-]1C=CC2=C(N=NC2=C1)C=CC3=CC=CC=C3.C1=CC(=C[C-]=C1)N.[Y+3]

Isomeric SMILES

[CH-]1C=CC2=C(N=NC2=C1)/C=C/C3=CC=CC=C3.C1=CC(=C[C-]=C1)N.[Y+3]

InChI

InChI=1S/C15H11N2.C6H6N.Y/c1-2-6-12(7-3-1)10-11-15-13-8-4-5-9-14(13)16-17-15;7-6-4-2-1-3-5-6;/h1-11H;1-2,4-5H,7H2;/q2*-1;+3/b11-10+;;