2-[4-(6,7-dimethoxy-1,2,3,4-tetrahydroisoquinolin-1-yl)butoxy]aniline

Systemtic Name: 2-[4-(6,7-dimethoxy-1,2,3,4-tetrahydroisoquinolin-1-yl)butoxy]aniline Openeye Name: 2-[4-(6,7-dimethoxy-1,2,3,4-tetrahydroisoquinolin-1-yl)butoxy]aniline CAS Name: 2-[4-(6,7-dimethoxy-1,2,3,4-tetrahydroisoquinolin-1-yl)butoxy]aniline IUPAC Name: 2-[4-(6,7-dimethoxy-1,2,3,4-tetrahydroisoquinolin-1-yl)butoxy]aniline Traditional Name: [2-[4-(6,7-dimethoxy-1,2,3,4-tetrahydroisoquinolin-1-yl)butoxy]phenyl]amine Formula: C21H28N2O3 MolecularWeight: 356.45862

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C2C(NCCC2=C1)CCCCOC3=CC=CC=C3N)OC

Isomeric SMILES

COC1=C(C=C2C(NCCC2=C1)CCCCOC3=CC=CC=C3N)OC

InChI

InChI=1S/C21H28N2O3/c1-24-20-13-15-10-11-23-18(16(15)14-21(20)25-2)8-5-6-12-26-19-9-4-3-7-17(19)22/h3-4,7,9,13-14,18,23H,5-6,8,10-12,22H2,1-2H3