6-[4-(2-hydroxyethyl)piperazin-1-yl]carbonyl-3,4-dihydro-1H-quinolin-2-one dihydrate

Systemtic Name: 6-[4-(2-hydroxyethyl)piperazin-1-yl]carbonyl-3,4-dihydro-1H-quinolin-2-one dihydrate Openeye Name: 6-[4-(2-hydroxyethyl)piperazine-1-carbonyl]-3,4-dihydro-1H-quinolin-2-one dihydrate CAS Name: 6-[[4-(2-hydroxyethyl)-1-piperazinyl]-oxomethyl]-3,4-dihydro-1H-quinolin-2-one dihydrate IUPAC Name: 6-[4-(2-hydroxyethyl)piperazine-1-carbonyl]-3,4-dihydro-1H-quinolin-2-one dihydrate Traditional Name: 6-[4-(2-hydroxyethyl)piperazine-1-carbonyl]-3,4-dihydrocarbostyril dihydrate Formula: C16H25N3O5 MolecularWeight: 339.3868

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Descriptors Computed from Structure

Canonical SMILES:

C1CC(=O)NC2=C1C=C(C=C2)C(=O)N3CCN(CC3)CCO.O.O

Isomeric SMILES

C1CC(=O)NC2=C1C=C(C=C2)C(=O)N3CCN(CC3)CCO.O.O

InChI

InChI=1S/C16H21N3O3.2H2O/c20-10-9-18-5-7-19(8-6-18)16(22)13-1-3-14-12(11-13)2-4-15(21)17-14;;/h1,3,11,20H,2,4-10H2,(H,17,21);2*1H2