4-[[[(E)-3-(1-cyclopropyl-2,5-dimethyl-pyrrol-3-yl)prop-2-enoyl]-methyl-amino]methyl]-N-methyl-benzamide

Systemtic Name: 4-[[[(E)-3-(1-cyclopropyl-2,5-dimethyl-pyrrol-3-yl)prop-2-enoyl]-methyl-amino]methyl]-N-methyl-benzamide Openeye Name: 4-[[[(E)-3-(1-cyclopropyl-2,5-dimethyl-pyrrol-3-yl)prop-2-enoyl]-methyl-amino]methyl]-N-methyl-benzamide CAS Name: 4-[[[(E)-3-(1-cyclopropyl-2,5-dimethyl-3-pyrrolyl)-1-oxoprop-2-enyl]-methylamino]methyl]-N-methylbenzamide IUPAC Name: 4-[[[(E)-3-(1-cyclopropyl-2,5-dimethylpyrrol-3-yl)prop-2-enoyl]-methylamino]methyl]-N-methylbenzamide Traditional Name: 4-[[[(E)-3-(1-cyclopropyl-2,5-dimethyl-pyrrol-3-yl)acryloyl]-methyl-amino]methyl]-N-methyl-benzamide Formula: C22H27N3O2 MolecularWeight: 365.46868

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(N1C2CC2)C)C=CC(=O)N(C)CC3=CC=C(C=C3)C(=O)NC

Isomeric SMILES

CC1=CC(=C(N1C2CC2)C)/C=C/C(=O)N(C)CC3=CC=C(C=C3)C(=O)NC

InChI

InChI=1S/C22H27N3O2/c1-15-13-19(16(2)25(15)20-10-11-20)9-12-21(26)24(4)14-17-5-7-18(8-6-17)22(27)23-3/h5-9,12-13,20H,10-11,14H2,1-4H3,(H,23,27)/b12-9+