6-methyl-2-[4-[(4-nitrophenyl)methyl]piperazin-1-yl]carbonyl-3,6-dihydro-2H-pyran-5-carboxylic acid

Systemtic Name: 6-methyl-2-[4-[(4-nitrophenyl)methyl]piperazin-1-yl]carbonyl-3,6-dihydro-2H-pyran-5-carboxylic acid Openeye Name: 6-methyl-2-[4-[(4-nitrophenyl)methyl]piperazine-1-carbonyl]-3,6-dihydro-2H-pyran-5-carboxylic acid CAS Name: 6-methyl-2-[[4-[(4-nitrophenyl)methyl]-1-piperazinyl]-oxomethyl]-3,6-dihydro-2H-pyran-5-carboxylic acid IUPAC Name: 6-methyl-2-[4-[(4-nitrophenyl)methyl]piperazine-1-carbonyl]-3,6-dihydro-2H-pyran-5-carboxylic acid Traditional Name: 6-methyl-2-[4-(4-nitrobenzyl)piperazine-1-carbonyl]-3,6-dihydro-2H-pyran-5-carboxylic acid Formula: C19H23N3O6 MolecularWeight: 389.40242

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Descriptors Computed from Structure

Canonical SMILES:

CC1C(=CCC(O1)C(=O)N2CCN(CC2)CC3=CC=C(C=C3)[N+](=O)[O-])C(=O)O

Isomeric SMILES

CC1C(=CCC(O1)C(=O)N2CCN(CC2)CC3=CC=C(C=C3)[N+](=O)[O-])C(=O)O

InChI

InChI=1S/C19H23N3O6/c1-13-16(19(24)25)6-7-17(28-13)18(23)21-10-8-20(9-11-21)12-14-2-4-15(5-3-14)22(26)27/h2-6,13,17H,7-12H2,1H3,(H,24,25)