3-[3-(1,3-benzoxazol-2-yl)piperidin-1-yl]-N-(4-methoxy-2-nitro-phenyl)propanamide

Systemtic Name: 3-[3-(1,3-benzoxazol-2-yl)piperidin-1-yl]-N-(4-methoxy-2-nitro-phenyl)propanamide Openeye Name: 3-[3-(1,3-benzoxazol-2-yl)-1-piperidyl]-N-(4-methoxy-2-nitro-phenyl)propanamide CAS Name: 3-[3-(1,3-benzoxazol-2-yl)-1-piperidinyl]-N-(4-methoxy-2-nitrophenyl)propanamide IUPAC Name: 3-[3-(1,3-benzoxazol-2-yl)piperidin-1-yl]-N-(4-methoxy-2-nitrophenyl)propanamide Traditional Name: 3-[3-(1,3-benzoxazol-2-yl)piperidino]-N-(4-methoxy-2-nitro-phenyl)propionamide Formula: C22H24N4O5 MolecularWeight: 424.44976

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC(=C(C=C1)NC(=O)CCN2CCCC(C2)C3=NC4=CC=CC=C4O3)[N+](=O)[O-]

Isomeric SMILES

COC1=CC(=C(C=C1)NC(=O)CCN2CCCC(C2)C3=NC4=CC=CC=C4O3)[N+](=O)[O-]

InChI

InChI=1S/C22H24N4O5/c1-30-16-8-9-17(19(13-16)26(28)29)23-21(27)10-12-25-11-4-5-15(14-25)22-24-18-6-2-3-7-20(18)31-22/h2-3,6-9,13,15H,4-5,10-12,14H2,1H3,(H,23,27)