N-(1,3-benzodioxol-5-ylmethyl)-2-[(4-ethoxy-3-morpholin-4-ylsulfonyl-phenyl)amino]propanamide

Systemtic Name: N-(1,3-benzodioxol-5-ylmethyl)-2-[(4-ethoxy-3-morpholin-4-ylsulfonyl-phenyl)amino]propanamide Openeye Name: N-(1,3-benzodioxol-5-ylmethyl)-2-(4-ethoxy-3-morpholinosulfonyl-anilino)propanamide CAS Name: N-(1,3-benzodioxol-5-ylmethyl)-2-[4-ethoxy-3-(4-morpholinylsulfonyl)anilino]propanamide IUPAC Name: N-(1,3-benzodioxol-5-ylmethyl)-2-(4-ethoxy-3-morpholin-4-ylsulfonylanilino)propanamide Traditional Name: 2-(4-ethoxy-3-morpholinosulfonyl-anilino)-N-piperonyl-propionamide Formula: C23H29N3O7S MolecularWeight: 491.55726

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=C(C=C(C=C1)NC(C)C(=O)NCC2=CC3=C(C=C2)OCO3)S(=O)(=O)N4CCOCC4

Isomeric SMILES

CCOC1=C(C=C(C=C1)NC(C)C(=O)NCC2=CC3=C(C=C2)OCO3)S(=O)(=O)N4CCOCC4

InChI

InChI=1S/C23H29N3O7S/c1-3-31-20-7-5-18(13-22(20)34(28,29)26-8-10-30-11-9-26)25-16(2)23(27)24-14-17-4-6-19-21(12-17)33-15-32-19/h4-7,12-13,16,25H,3,8-11,14-15H2,1-2H3,(H,24,27)