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6,7-dimethoxy-2-[(2S)-2-methylbutanoyl]-3,4-dihydro-1H-isoquinoline-1-carbonitrile

6,7-dimethoxy-2-[(2S)-2-methylbutanoyl]-3,4-dihydro-1H-isoquinoline-1-carbonitrile

Systemtic Name:6,7-dimethoxy-2-[(2S)-2-methylbutanoyl]-3,4-dihydro-1H-isoquinoline-1-carbonitrile
Openeye Name:6,7-dimethoxy-2-[(2S)-2-methylbutanoyl]-3,4-dihydro-1H-isoquinoline-1-carbonitrile
CAS Name:6,7-dimethoxy-2-[(2S)-2-methyl-1-oxobutyl]-3,4-dihydro-1H-isoquinoline-1-carbonitrile
IUPAC Name:6,7-dimethoxy-2-[(2S)-2-methylbutanoyl]-3,4-dihydro-1H-isoquinoline-1-carbonitrile
Traditional Name:6,7-dimethoxy-2-[(2S)-2-methylbutanoyl]-3,4-dihydro-1H-isoquinoline-1-carbonitrile
Formula: C17H22N2O3
MolecularWeight: 302.36818
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Descriptors Computed from Structure

Canonical SMILES:

CCC(C)C(=O)N1CCC2=CC(=C(C=C2C1C#N)OC)OC


Isomeric SMILES

CC[C@H](C)C(=O)N1CCC2=CC(=C(C=C2C1C#N)OC)OC


InChI

InChI=1S/C17H22N2O3/c1-5-11(2)17(20)19-7-6-12-8-15(21-3)16(22-4)9-13(12)14(19)10-18/h8-9,11,14H,5-7H2,1-4H3/t11-,14?/m0/s1


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