3-[(6-nitro-2-oxidanylidene-naphthalen-1-ylidene)methylamino]-2-propyl-quinazolin-4-one

Systemtic Name: 3-[(6-nitro-2-oxidanylidene-naphthalen-1-ylidene)methylamino]-2-propyl-quinazolin-4-one Openeye Name: 3-[(6-nitro-2-oxo-1-naphthylidene)methylamino]-2-propyl-quinazolin-4-one CAS Name: 3-[(6-nitro-2-oxo-1-naphthalenylidene)methylamino]-2-propyl-4-quinazolinone IUPAC Name: 3-[(6-nitro-2-oxonaphthalen-1-ylidene)methylamino]-2-propylquinazolin-4-one Traditional Name: 3-[(2-keto-6-nitro-1-naphthylidene)methylamino]-2-propyl-quinazolin-4-one Formula: C22H18N4O4 MolecularWeight: 402.40272

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Descriptors Computed from Structure

Canonical SMILES:

CCCC1=NC2=CC=CC=C2C(=O)N1NC=C3C4=C(C=CC3=O)C=C(C=C4)[N+](=O)[O-]

Isomeric SMILES

CCCC1=NC2=CC=CC=C2C(=O)N1NC=C3C4=C(C=CC3=O)C=C(C=C4)[N+](=O)[O-]

InChI

InChI=1S/C22H18N4O4/c1-2-5-21-24-19-7-4-3-6-17(19)22(28)25(21)23-13-18-16-10-9-15(26(29)30)12-14(16)8-11-20(18)27/h3-4,6-13,23H,2,5H2,1H3