4-hexyl-N-[2-[2-methylpropyl-[(1-methylpyrrol-2-yl)methyl]amino]-2-oxidanylidene-ethyl]-N-prop-2-enyl-benzamide

Systemtic Name: 4-hexyl-N-[2-[2-methylpropyl-[(1-methylpyrrol-2-yl)methyl]amino]-2-oxidanylidene-ethyl]-N-prop-2-enyl-benzamide Openeye Name: N-allyl-4-hexyl-N-[2-[isobutyl-[(1-methylpyrrol-2-yl)methyl]amino]-2-oxo-ethyl]benzamide CAS Name: 4-hexyl-N-[2-[2-methylpropyl-[(1-methyl-2-pyrrolyl)methyl]amino]-2-oxoethyl]-N-prop-2-enylbenzamide IUPAC Name: 4-hexyl-N-[2-[2-methylpropyl-[(1-methylpyrrol-2-yl)methyl]amino]-2-oxoethyl]-N-prop-2-enylbenzamide Traditional Name: N-allyl-4-hexyl-N-[2-[isobutyl-[(1-methylpyrrol-2-yl)methyl]amino]-2-keto-ethyl]benzamide Formula: C28H41N3O2 MolecularWeight: 451.64404

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCC1=CC=C(C=C1)C(=O)N(CC=C)CC(=O)N(CC2=CC=CN2C)CC(C)C

Isomeric SMILES

CCCCCCC1=CC=C(C=C1)C(=O)N(CC=C)CC(=O)N(CC2=CC=CN2C)CC(C)C

InChI

InChI=1S/C28H41N3O2/c1-6-8-9-10-12-24-14-16-25(17-15-24)28(33)30(18-7-2)22-27(32)31(20-23(3)4)21-26-13-11-19-29(26)5/h7,11,13-17,19,23H,2,6,8-10,12,18,20-22H2,1,3-5H3