methyl 1-(pentan-3-ylamino)isoquinoline-4-carboxylate

Systemtic Name: methyl 1-(pentan-3-ylamino)isoquinoline-4-carboxylate Openeye Name: methyl 1-(1-ethylpropylamino)isoquinoline-4-carboxylate CAS Name: 1-(pentan-3-ylamino)-4-isoquinolinecarboxylic acid methyl ester IUPAC Name: methyl 1-(pentan-3-ylamino)isoquinoline-4-carboxylate Traditional Name: 1-(1-ethylpropylamino)isoquinoline-4-carboxylic acid methyl ester Formula: C16H20N2O2 MolecularWeight: 272.3422

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Descriptors Computed from Structure

Canonical SMILES:

CCC(CC)NC1=NC=C(C2=CC=CC=C21)C(=O)OC

Isomeric SMILES

CCC(CC)NC1=NC=C(C2=CC=CC=C21)C(=O)OC

InChI

InChI=1S/C16H20N2O2/c1-4-11(5-2)18-15-13-9-7-6-8-12(13)14(10-17-15)16(19)20-3/h6-11H,4-5H2,1-3H3,(H,17,18)