methyl 1-[(E)-hex-1-enyl]-1H-isoquinoline-2-carboxylate

Systemtic Name: methyl 1-[(E)-hex-1-enyl]-1H-isoquinoline-2-carboxylate Openeye Name: methyl 1-[(E)-hex-1-enyl]-1H-isoquinoline-2-carboxylate CAS Name: 1-[(E)-hex-1-enyl]-1H-isoquinoline-2-carboxylic acid methyl ester IUPAC Name: methyl 1-[(E)-hex-1-enyl]-1H-isoquinoline-2-carboxylate Traditional Name: 1-[(E)-hex-1-enyl]-1H-isoquinoline-2-carboxylic acid methyl ester Formula: C17H21NO2 MolecularWeight: 271.35414

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC=CC1C2=CC=CC=C2C=CN1C(=O)OC

Isomeric SMILES

CCCC/C=C/C1C2=CC=CC=C2C=CN1C(=O)OC

InChI

InChI=1S/C17H21NO2/c1-3-4-5-6-11-16-15-10-8-7-9-14(15)12-13-18(16)17(19)20-2/h6-13,16H,3-5H2,1-2H3/b11-6+