methyl 5-(3-butyl-2-methylidene-heptyl)-1-methyl-pyrrole-2-carboxylate

Systemtic Name: methyl 5-(3-butyl-2-methylidene-heptyl)-1-methyl-pyrrole-2-carboxylate Openeye Name: methyl 5-(3-butyl-2-methylene-heptyl)-1-methyl-pyrrole-2-carboxylate CAS Name: 5-(3-butyl-2-methyleneheptyl)-1-methyl-2-pyrrolecarboxylic acid methyl ester IUPAC Name: methyl 5-(3-butyl-2-methylideneheptyl)-1-methylpyrrole-2-carboxylate Traditional Name: 5-[2-(1-butylpentyl)allyl]-1-methyl-pyrrole-2-carboxylic acid methyl ester Formula: C19H31NO2 MolecularWeight: 305.45494

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC(CCCC)C(=C)CC1=CC=C(N1C)C(=O)OC

Isomeric SMILES

CCCCC(CCCC)C(=C)CC1=CC=C(N1C)C(=O)OC

InChI

InChI=1S/C19H31NO2/c1-6-8-10-16(11-9-7-2)15(3)14-17-12-13-18(20(17)4)19(21)22-5/h12-13,16H,3,6-11,14H2,1-2,4-5H3