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methyl 3-(aminomethyl)-4-butoxy-2-(2-methylpropyl)-1-oxidanylidene-isoquinoline-6-carboxylate hydrochloride

methyl 3-(aminomethyl)-4-butoxy-2-(2-methylpropyl)-1-oxidanylidene-isoquinoline-6-carboxylate hydrochloride

Systemtic Name:methyl 3-(aminomethyl)-4-butoxy-2-(2-methylpropyl)-1-oxidanylidene-isoquinoline-6-carboxylate hydrochloride
Openeye Name:methyl 3-(aminomethyl)-4-butoxy-2-isobutyl-1-oxo-isoquinoline-6-carboxylate hydrochloride
CAS Name:3-(aminomethyl)-4-butoxy-2-(2-methylpropyl)-1-oxo-6-isoquinolinecarboxylic acid methyl ester hydrochloride
IUPAC Name:methyl 3-(aminomethyl)-4-butoxy-2-(2-methylpropyl)-1-oxoisoquinoline-6-carboxylate hydrochloride
Traditional Name:3-(aminomethyl)-4-butoxy-2-isobutyl-1-keto-isoquinoline-6-carboxylic acid methyl ester hydrochloride
Formula: C20H29ClN2O4
MolecularWeight: 396.90826
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Descriptors Computed from Structure

Canonical SMILES:

CCCCOC1=C(N(C(=O)C2=C1C=C(C=C2)C(=O)OC)CC(C)C)CN.Cl


Isomeric SMILES

CCCCOC1=C(N(C(=O)C2=C1C=C(C=C2)C(=O)OC)CC(C)C)CN.Cl


InChI

InChI=1S/C20H28N2O4.ClH/c1-5-6-9-26-18-16-10-14(20(24)25-4)7-8-15(16)19(23)22(12-13(2)3)17(18)11-21;/h7-8,10,13H,5-6,9,11-12,21H2,1-4H3;1H


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