4-chloranyl-2-[(2-nitrophenyl)amino]-6,7,8,8a-tetrahydro-5H-quinazoline-1-carboxamide

Systemtic Name: 4-chloranyl-2-[(2-nitrophenyl)amino]-6,7,8,8a-tetrahydro-5H-quinazoline-1-carboxamide Openeye Name: 4-chloro-2-(2-nitroanilino)-6,7,8,8a-tetrahydro-5H-quinazoline-1-carboxamide CAS Name: 4-chloro-2-(2-nitroanilino)-6,7,8,8a-tetrahydro-5H-quinazoline-1-carboxamide IUPAC Name: 4-chloro-2-(2-nitroanilino)-6,7,8,8a-tetrahydro-5H-quinazoline-1-carboxamide Traditional Name: 4-chloro-2-(2-nitroanilino)-6,7,8,8a-tetrahydro-5H-quinazoline-1-carboxamide Formula: C15H16ClN5O3 MolecularWeight: 349.77224

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC2=C(N=C(N(C2C1)C(=O)N)NC3=CC=CC=C3[N+](=O)[O-])Cl

Isomeric SMILES

C1CCC2=C(N=C(N(C2C1)C(=O)N)NC3=CC=CC=C3[N+](=O)[O-])Cl

InChI

InChI=1S/C15H16ClN5O3/c16-13-9-5-1-3-7-11(9)20(14(17)22)15(19-13)18-10-6-2-4-8-12(10)21(23)24/h2,4,6,8,11H,1,3,5,7H2,(H2,17,22)(H,18,19)