propyl N'-(1,3-benzodioxol-5-ylmethyl)-N-(3-methylphenyl)carbonyl-carbamimidate

Systemtic Name: propyl N'-(1,3-benzodioxol-5-ylmethyl)-N-(3-methylphenyl)carbonyl-carbamimidate Openeye Name: N-[N-(1,3-benzodioxol-5-ylmethyl)-C-propoxy-carbonimidoyl]-3-methyl-benzamide CAS Name: N'-(1,3-benzodioxol-5-ylmethyl)-N-[(3-methylphenyl)-oxomethyl]carbamimidic acid propyl ester IUPAC Name: propyl N'-(1,3-benzodioxol-5-ylmethyl)-N-(3-methylbenzoyl)carbamimidate Traditional Name: 3-methyl-N-(N-piperonyl-C-propoxy-carbonimidoyl)benzamide Formula: C20H22N2O4 MolecularWeight: 354.39968

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Descriptors Computed from Structure

Canonical SMILES:

CCCOC(=NCC1=CC2=C(C=C1)OCO2)NC(=O)C3=CC(=CC=C3)C

Isomeric SMILES

CCCOC(=NCC1=CC2=C(C=C1)OCO2)NC(=O)C3=CC(=CC=C3)C

InChI

InChI=1S/C20H22N2O4/c1-3-9-24-20(22-19(23)16-6-4-5-14(2)10-16)21-12-15-7-8-17-18(11-15)26-13-25-17/h4-8,10-11H,3,9,12-13H2,1-2H3,(H,21,22,23)