4-(6-oxidanyl-6,7,8,9-tetrahydro-5H-benzo[7]annulen-5-yl)piperazine-1-carboxylate

Systemtic Name: 4-(6-oxidanyl-6,7,8,9-tetrahydro-5H-benzo[7]annulen-5-yl)piperazine-1-carboxylate Openeye Name: 4-(6-hydroxy-6,7,8,9-tetrahydro-5H-benzo[7]annulen-5-yl)piperazine-1-carboxylate CAS Name: 4-(6-hydroxy-6,7,8,9-tetrahydro-5H-benzo[7]annulen-5-yl)-1-piperazinecarboxylate IUPAC Name: 4-(6-hydroxy-6,7,8,9-tetrahydro-5H-benzo[7]annulen-5-yl)piperazine-1-carboxylate Traditional Name: 4-(6-hydroxy-6,7,8,9-tetrahydro-5H-benzocyclohepten-5-yl)piperazine-1-carboxylate Formula: C16H21N2O3- MolecularWeight: 289.34954

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Descriptors Computed from Structure

Canonical SMILES:

C1CC(C(C2=CC=CC=C2C1)N3CCN(CC3)C(=O)[O-])O

Isomeric SMILES

C1CC(C(C2=CC=CC=C2C1)N3CCN(CC3)C(=O)[O-])O

InChI

InChI=1S/C16H22N2O3/c19-14-7-3-5-12-4-1-2-6-13(12)15(14)17-8-10-18(11-9-17)16(20)21/h1-2,4,6,14-15,19H,3,5,7-11H2,(H,20,21)/p-1