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1-[ethyl(2-methylprop-2-enyl)amino]isoquinoline-3-carboxylic acid

1-[ethyl(2-methylprop-2-enyl)amino]isoquinoline-3-carboxylic acid

Systemtic Name:1-[ethyl(2-methylprop-2-enyl)amino]isoquinoline-3-carboxylic acid
Openeye Name:1-[ethyl(2-methylallyl)amino]isoquinoline-3-carboxylic acid
CAS Name:1-[ethyl(2-methylprop-2-enyl)amino]-3-isoquinolinecarboxylic acid
IUPAC Name:1-[ethyl(2-methylprop-2-enyl)amino]isoquinoline-3-carboxylic acid
Traditional Name:1-[ethyl(2-methylallyl)amino]isoquinoline-3-carboxylic acid
Formula: C16H18N2O2
MolecularWeight: 270.32632
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Descriptors Computed from Structure

Canonical SMILES:

CCN(CC(=C)C)C1=NC(=CC2=CC=CC=C21)C(=O)O


Isomeric SMILES

CCN(CC(=C)C)C1=NC(=CC2=CC=CC=C21)C(=O)O


InChI

InChI=1S/C16H18N2O2/c1-4-18(10-11(2)3)15-13-8-6-5-7-12(13)9-14(17-15)16(19)20/h5-9H,2,4,10H2,1,3H3,(H,19,20)


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