5-azanyl-6-chloranyl-N-[1-[3-(3-ethyl-2-oxidanylidene-benzimidazol-1-yl)propyl]-3-methoxy-piperidin-4-yl]-2,3-dihydro-1,4-benzodioxine-8-carboxamide

Systemtic Name: 5-azanyl-6-chloranyl-N-[1-[3-(3-ethyl-2-oxidanylidene-benzimidazol-1-yl)propyl]-3-methoxy-piperidin-4-yl]-2,3-dihydro-1,4-benzodioxine-8-carboxamide Openeye Name: 5-amino-6-chloro-N-[1-[3-(3-ethyl-2-oxo-benzimidazol-1-yl)propyl]-3-methoxy-4-piperidyl]-2,3-dihydro-1,4-benzodioxine-8-carboxamide CAS Name: 5-amino-6-chloro-N-[1-[3-(3-ethyl-2-oxo-1-benzimidazolyl)propyl]-3-methoxy-4-piperidinyl]-2,3-dihydro-1,4-benzodioxin-8-carboxamide IUPAC Name: 5-amino-6-chloro-N-[1-[3-(3-ethyl-2-oxobenzimidazol-1-yl)propyl]-3-methoxypiperidin-4-yl]-2,3-dihydro-1,4-benzodioxine-8-carboxamide Traditional Name: 5-amino-6-chloro-N-[1-[3-(3-ethyl-2-keto-benzimidazol-1-yl)propyl]-3-methoxy-4-piperidyl]-2,3-dihydro-1,4-benzodioxin-8-carboxamide Formula: C27H34ClN5O5 MolecularWeight: 544.04236

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCN1C2=CC=CC=C2N(C1=O)CCCN3CCC(C(C3)OC)NC(=O)C4=CC(=C(C5=C4OCCO5)N)Cl

Isomeric SMILES

CCN1C2=CC=CC=C2N(C1=O)CCCN3CCC(C(C3)OC)NC(=O)C4=CC(=C(C5=C4OCCO5)N)Cl

InChI

InChI=1S/C27H34ClN5O5/c1-3-32-20-7-4-5-8-21(20)33(27(32)35)11-6-10-31-12-9-19(22(16-31)36-2)30-26(34)17-15-18(28)23(29)25-24(17)37-13-14-38-25/h4-5,7-8,15,19,22H,3,6,9-14,16,29H2,1-2H3,(H,30,34)