N-(1,3-benzodioxol-5-ylmethyl)-3,5-dimethyl-1-[(3-methylphenyl)methyl]-4-morpholin-4-yl-pyrrole-2-carboxamide

Systemtic Name: N-(1,3-benzodioxol-5-ylmethyl)-3,5-dimethyl-1-[(3-methylphenyl)methyl]-4-morpholin-4-yl-pyrrole-2-carboxamide Openeye Name: N-(1,3-benzodioxol-5-ylmethyl)-3,5-dimethyl-4-morpholino-1-(m-tolylmethyl)pyrrole-2-carboxamide CAS Name: N-(1,3-benzodioxol-5-ylmethyl)-3,5-dimethyl-1-[(3-methylphenyl)methyl]-4-(4-morpholinyl)-2-pyrrolecarboxamide IUPAC Name: N-(1,3-benzodioxol-5-ylmethyl)-3,5-dimethyl-1-[(3-methylphenyl)methyl]-4-morpholin-4-ylpyrrole-2-carboxamide Traditional Name: 3,5-dimethyl-1-(3-methylbenzyl)-4-morpholino-N-piperonyl-pyrrole-2-carboxamide Formula: C27H31N3O4 MolecularWeight: 461.55274

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC=C1)CN2C(=C(C(=C2C(=O)NCC3=CC4=C(C=C3)OCO4)C)N5CCOCC5)C

Isomeric SMILES

CC1=CC(=CC=C1)CN2C(=C(C(=C2C(=O)NCC3=CC4=C(C=C3)OCO4)C)N5CCOCC5)C

InChI

InChI=1S/C27H31N3O4/c1-18-5-4-6-22(13-18)16-30-20(3)25(29-9-11-32-12-10-29)19(2)26(30)27(31)28-15-21-7-8-23-24(14-21)34-17-33-23/h4-8,13-14H,9-12,15-17H2,1-3H3,(H,28,31)