2-[(Z)-[[3-(3-methoxypropyl)-4-oxidanylidene-quinazolin-2-yl]hydrazinylidene]methyl]-4-nitro-phenolate

Systemtic Name: 2-[(Z)-[[3-(3-methoxypropyl)-4-oxidanylidene-quinazolin-2-yl]hydrazinylidene]methyl]-4-nitro-phenolate Openeye Name: 2-[(Z)-[[3-(3-methoxypropyl)-4-oxo-quinazolin-2-yl]hydrazono]methyl]-4-nitro-phenolate CAS Name: 2-[(Z)-[[3-(3-methoxypropyl)-4-oxo-2-quinazolinyl]hydrazinylidene]methyl]-4-nitrophenolate IUPAC Name: 2-[(Z)-[[3-(3-methoxypropyl)-4-oxoquinazolin-2-yl]hydrazinylidene]methyl]-4-nitrophenolate Traditional Name: 2-[(Z)-[[4-keto-3-(3-methoxypropyl)quinazolin-2-yl]hydrazono]methyl]-4-nitro-phenolate Formula: C19H18N5O5- MolecularWeight: 396.37672

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Descriptors Computed from Structure

Canonical SMILES:

COCCCN1C(=O)C2=CC=CC=C2N=C1NN=CC3=C(C=CC(=C3)[N+](=O)[O-])[O-]

Isomeric SMILES

COCCCN1C(=O)C2=CC=CC=C2N=C1N/N=C\C3=C(C=CC(=C3)[N+](=O)[O-])[O-]

InChI

InChI=1S/C19H19N5O5/c1-29-10-4-9-23-18(26)15-5-2-3-6-16(15)21-19(23)22-20-12-13-11-14(24(27)28)7-8-17(13)25/h2-3,5-8,11-12,25H,4,9-10H2,1H3,(H,21,22)/p-1/b20-12-