4-butyl-N-[[1-[(3-methoxyphenyl)methyl]pyrrol-2-yl]methyl]-N-prop-2-enyl-benzamide

Systemtic Name: 4-butyl-N-[[1-[(3-methoxyphenyl)methyl]pyrrol-2-yl]methyl]-N-prop-2-enyl-benzamide Openeye Name: N-allyl-4-butyl-N-[[1-[(3-methoxyphenyl)methyl]pyrrol-2-yl]methyl]benzamide CAS Name: 4-butyl-N-[[1-[(3-methoxyphenyl)methyl]-2-pyrrolyl]methyl]-N-prop-2-enylbenzamide IUPAC Name: 4-butyl-N-[[1-[(3-methoxyphenyl)methyl]pyrrol-2-yl]methyl]-N-prop-2-enylbenzamide Traditional Name: N-allyl-4-butyl-N-[(1-m-anisylpyrrol-2-yl)methyl]benzamide Formula: C27H32N2O2 MolecularWeight: 416.55518

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC1=CC=C(C=C1)C(=O)N(CC=C)CC2=CC=CN2CC3=CC(=CC=C3)OC

Isomeric SMILES

CCCCC1=CC=C(C=C1)C(=O)N(CC=C)CC2=CC=CN2CC3=CC(=CC=C3)OC

InChI

InChI=1S/C27H32N2O2/c1-4-6-9-22-13-15-24(16-14-22)27(30)29(17-5-2)21-25-11-8-18-28(25)20-23-10-7-12-26(19-23)31-3/h5,7-8,10-16,18-19H,2,4,6,9,17,20-21H2,1,3H3