3-[[(2-tert-butylphenyl)amino]-(1,2,3,4-tetrazol-5-ylidene)methyl]-1-methyl-4-oxidanylidene-quinolin-2-olate

Systemtic Name: 3-[[(2-tert-butylphenyl)amino]-(1,2,3,4-tetrazol-5-ylidene)methyl]-1-methyl-4-oxidanylidene-quinolin-2-olate Openeye Name: 3-[(2-tert-butylanilino)-(tetrazol-5-ylidene)methyl]-1-methyl-4-oxo-quinolin-2-olate CAS Name: 3-[(2-tert-butylanilino)-(5-tetrazolylidene)methyl]-1-methyl-4-oxo-2-quinolinolate IUPAC Name: 3-[(2-tert-butylanilino)-(tetrazol-5-ylidene)methyl]-1-methyl-4-oxoquinolin-2-olate Traditional Name: 3-[(2-tert-butylanilino)-(tetrazol-5-ylidene)methyl]-4-keto-1-methyl-quinolin-2-olate Formula: C22H21N6O2- MolecularWeight: 401.44114

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C1=CC=CC=C1NC(=C2N=NN=N2)C3=C(N(C4=CC=CC=C4C3=O)C)[O-]

Isomeric SMILES

CC(C)(C)C1=CC=CC=C1NC(=C2N=NN=N2)C3=C(N(C4=CC=CC=C4C3=O)C)[O-]

InChI

InChI=1S/C22H22N6O2/c1-22(2,3)14-10-6-7-11-15(14)23-18(20-24-26-27-25-20)17-19(29)13-9-5-8-12-16(13)28(4)21(17)30/h5-12,23,30H,1-4H3/p-1