1-(4-nitrophenyl)-7a-pyrrolidin-1-yl-4,5,6,7-tetrahydro-3aH-benzotriazole

Systemtic Name: 1-(4-nitrophenyl)-7a-pyrrolidin-1-yl-4,5,6,7-tetrahydro-3aH-benzotriazole Openeye Name: 1-(4-nitrophenyl)-7a-pyrrolidin-1-yl-4,5,6,7-tetrahydro-3aH-benzotriazole CAS Name: 1-(4-nitrophenyl)-7a-(1-pyrrolidinyl)-4,5,6,7-tetrahydro-3aH-benzotriazole IUPAC Name: 1-(4-nitrophenyl)-7a-pyrrolidin-1-yl-4,5,6,7-tetrahydro-3aH-benzotriazole Traditional Name: 1-(4-nitrophenyl)-7a-pyrrolidino-4,5,6,7-tetrahydro-3aH-benzotriazole Formula: C16H21N5O2 MolecularWeight: 315.37024

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC2(C(C1)N=NN2C3=CC=C(C=C3)[N+](=O)[O-])N4CCCC4

Isomeric SMILES

C1CCC2(C(C1)N=NN2C3=CC=C(C=C3)[N+](=O)[O-])N4CCCC4

InChI

InChI=1S/C16H21N5O2/c22-21(23)14-8-6-13(7-9-14)20-16(19-11-3-4-12-19)10-2-1-5-15(16)17-18-20/h6-9,15H,1-5,10-12H2