N-(1,3-benzodioxol-5-ylmethyl)-4-(6-chloranyl-2-methyl-2,3-dihydro-1,4-benzoxazin-4-yl)-4-oxidanylidene-butanamide

Systemtic Name: N-(1,3-benzodioxol-5-ylmethyl)-4-(6-chloranyl-2-methyl-2,3-dihydro-1,4-benzoxazin-4-yl)-4-oxidanylidene-butanamide Openeye Name: N-(1,3-benzodioxol-5-ylmethyl)-4-(6-chloro-2-methyl-2,3-dihydro-1,4-benzoxazin-4-yl)-4-oxo-butanamide CAS Name: N-(1,3-benzodioxol-5-ylmethyl)-4-(6-chloro-2-methyl-2,3-dihydro-1,4-benzoxazin-4-yl)-4-oxobutanamide IUPAC Name: N-(1,3-benzodioxol-5-ylmethyl)-4-(6-chloro-2-methyl-2,3-dihydro-1,4-benzoxazin-4-yl)-4-oxobutanamide Traditional Name: 4-(6-chloro-2-methyl-2,3-dihydro-1,4-benzoxazin-4-yl)-4-keto-N-piperonyl-butyramide Formula: C21H21ClN2O5 MolecularWeight: 416.85484

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Descriptors Computed from Structure

Canonical SMILES:

CC1CN(C2=C(O1)C=CC(=C2)Cl)C(=O)CCC(=O)NCC3=CC4=C(C=C3)OCO4

Isomeric SMILES

CC1CN(C2=C(O1)C=CC(=C2)Cl)C(=O)CCC(=O)NCC3=CC4=C(C=C3)OCO4

InChI

InChI=1S/C21H21ClN2O5/c1-13-11-24(16-9-15(22)3-5-17(16)29-13)21(26)7-6-20(25)23-10-14-2-4-18-19(8-14)28-12-27-18/h2-5,8-9,13H,6-7,10-12H2,1H3,(H,23,25)