3-hepta-1,6-dien-4-yl-2,5-dimethyl-1-(4-methylphenyl)pyrrole

Systemtic Name: 3-hepta-1,6-dien-4-yl-2,5-dimethyl-1-(4-methylphenyl)pyrrole Openeye Name: 3-(1-allylbut-3-enyl)-2,5-dimethyl-1-(p-tolyl)pyrrole CAS Name: 3-hepta-1,6-dien-4-yl-2,5-dimethyl-1-(4-methylphenyl)pyrrole IUPAC Name: 3-hepta-1,6-dien-4-yl-2,5-dimethyl-1-(4-methylphenyl)pyrrole Traditional Name: 3-(1-allylbut-3-enyl)-2,5-dimethyl-1-(p-tolyl)pyrrole Formula: C20H25N MolecularWeight: 279.4192

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)N2C(=CC(=C2C)C(CC=C)CC=C)C

Isomeric SMILES

CC1=CC=C(C=C1)N2C(=CC(=C2C)C(CC=C)CC=C)C

InChI

InChI=1S/C20H25N/c1-6-8-18(9-7-2)20-14-16(4)21(17(20)5)19-12-10-15(3)11-13-19/h6-7,10-14,18H,1-2,8-9H2,3-5H3