methyl 1-butylisoquinoline-7-carboxylate

Systemtic Name: methyl 1-butylisoquinoline-7-carboxylate Openeye Name: methyl 1-butylisoquinoline-7-carboxylate CAS Name: 1-butyl-7-isoquinolinecarboxylic acid methyl ester IUPAC Name: methyl 1-butylisoquinoline-7-carboxylate Traditional Name: 1-butylisoquinoline-7-carboxylic acid methyl ester Formula: C15H17NO2 MolecularWeight: 243.30098

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCCC1=NC=CC2=C1C=C(C=C2)C(=O)OC

Isomeric SMILES

CCCCC1=NC=CC2=C1C=C(C=C2)C(=O)OC

InChI

InChI=1S/C15H17NO2/c1-3-4-5-14-13-10-12(15(17)18-2)7-6-11(13)8-9-16-14/h6-10H,3-5H2,1-2H3