3-(4-tert-butylphenyl)-7-chloranyl-6-nitro-4-(2-piperidin-2-ylethoxy)-1H-quinolin-2-one

Systemtic Name: 3-(4-tert-butylphenyl)-7-chloranyl-6-nitro-4-(2-piperidin-2-ylethoxy)-1H-quinolin-2-one Openeye Name: 3-(4-tert-butylphenyl)-7-chloro-6-nitro-4-[2-(2-piperidyl)ethoxy]-1H-quinolin-2-one CAS Name: 3-(4-tert-butylphenyl)-7-chloro-6-nitro-4-[2-(2-piperidinyl)ethoxy]-1H-quinolin-2-one IUPAC Name: 3-(4-tert-butylphenyl)-7-chloro-6-nitro-4-(2-piperidin-2-ylethoxy)-1H-quinolin-2-one Traditional Name: 3-(4-tert-butylphenyl)-7-chloro-6-nitro-4-[2-(2-piperidyl)ethoxy]carbostyril Formula: C26H30ClN3O4 MolecularWeight: 483.9871

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C1=CC=C(C=C1)C2=C(C3=CC(=C(C=C3NC2=O)Cl)[N+](=O)[O-])OCCC4CCCCN4

Isomeric SMILES

CC(C)(C)C1=CC=C(C=C1)C2=C(C3=CC(=C(C=C3NC2=O)Cl)[N+](=O)[O-])OCCC4CCCCN4

InChI

InChI=1S/C26H30ClN3O4/c1-26(2,3)17-9-7-16(8-10-17)23-24(34-13-11-18-6-4-5-12-28-18)19-14-22(30(32)33)20(27)15-21(19)29-25(23)31/h7-10,14-15,18,28H,4-6,11-13H2,1-3H3,(H,29,31)