N-[2-[tert-butyl-[[1-[(3-methylphenyl)methyl]pyrrol-2-yl]methyl]amino]-2-oxidanylidene-ethyl]-N-(2-methoxyethyl)-1,3-benzodioxole-5-carboxamide

Systemtic Name: N-[2-[tert-butyl-[[1-[(3-methylphenyl)methyl]pyrrol-2-yl]methyl]amino]-2-oxidanylidene-ethyl]-N-(2-methoxyethyl)-1,3-benzodioxole-5-carboxamide Openeye Name: N-[2-[tert-butyl-[[1-(m-tolylmethyl)pyrrol-2-yl]methyl]amino]-2-oxo-ethyl]-N-(2-methoxyethyl)-1,3-benzodioxole-5-carboxamide CAS Name: N-[2-[tert-butyl-[[1-[(3-methylphenyl)methyl]-2-pyrrolyl]methyl]amino]-2-oxoethyl]-N-(2-methoxyethyl)-1,3-benzodioxole-5-carboxamide IUPAC Name: N-[2-[tert-butyl-[[1-[(3-methylphenyl)methyl]pyrrol-2-yl]methyl]amino]-2-oxoethyl]-N-(2-methoxyethyl)-1,3-benzodioxole-5-carboxamide Traditional Name: N-[2-[tert-butyl-[[1-(3-methylbenzyl)pyrrol-2-yl]methyl]amino]-2-keto-ethyl]-N-(2-methoxyethyl)-piperonylamide Formula: C30H37N3O5 MolecularWeight: 519.63188

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC=C1)CN2C=CC=C2CN(C(=O)CN(CCOC)C(=O)C3=CC4=C(C=C3)OCO4)C(C)(C)C

Isomeric SMILES

CC1=CC(=CC=C1)CN2C=CC=C2CN(C(=O)CN(CCOC)C(=O)C3=CC4=C(C=C3)OCO4)C(C)(C)C

InChI

InChI=1S/C30H37N3O5/c1-22-8-6-9-23(16-22)18-31-13-7-10-25(31)19-33(30(2,3)4)28(34)20-32(14-15-36-5)29(35)24-11-12-26-27(17-24)38-21-37-26/h6-13,16-17H,14-15,18-21H2,1-5H3