N-(1,3-benzodioxol-5-ylmethyl)-2-[[2-[(2-methoxy-5-methyl-phenyl)amino]-2-oxidanylidene-ethyl]amino]propanamide

Systemtic Name: N-(1,3-benzodioxol-5-ylmethyl)-2-[[2-[(2-methoxy-5-methyl-phenyl)amino]-2-oxidanylidene-ethyl]amino]propanamide Openeye Name: N-(1,3-benzodioxol-5-ylmethyl)-2-[[2-(2-methoxy-5-methyl-anilino)-2-oxo-ethyl]amino]propanamide CAS Name: N-(1,3-benzodioxol-5-ylmethyl)-2-[[2-(2-methoxy-5-methylanilino)-2-oxoethyl]amino]propanamide IUPAC Name: N-(1,3-benzodioxol-5-ylmethyl)-2-[[2-(2-methoxy-5-methylanilino)-2-oxoethyl]amino]propanamide Traditional Name: 2-[[2-keto-2-(2-methoxy-5-methyl-anilino)ethyl]amino]-N-piperonyl-propionamide Formula: C21H25N3O5 MolecularWeight: 399.4403

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1)OC)NC(=O)CNC(C)C(=O)NCC2=CC3=C(C=C2)OCO3

Isomeric SMILES

CC1=CC(=C(C=C1)OC)NC(=O)CNC(C)C(=O)NCC2=CC3=C(C=C2)OCO3

InChI

InChI=1S/C21H25N3O5/c1-13-4-6-17(27-3)16(8-13)24-20(25)11-22-14(2)21(26)23-10-15-5-7-18-19(9-15)29-12-28-18/h4-9,14,22H,10-12H2,1-3H3,(H,23,26)(H,24,25)