ethanoic acid; 5-methoxy-1-(pyrrolidin-1-ylmethyl)-1,2,3,4-tetrahydroisoquinoline

Systemtic Name: ethanoic acid; 5-methoxy-1-(pyrrolidin-1-ylmethyl)-1,2,3,4-tetrahydroisoquinoline Openeye Name: acetic acid; 5-methoxy-1-(pyrrolidin-1-ylmethyl)-1,2,3,4-tetrahydroisoquinoline CAS Name: acetic acid; 5-methoxy-1-(1-pyrrolidinylmethyl)-1,2,3,4-tetrahydroisoquinoline IUPAC Name: acetic acid; 5-methoxy-1-(pyrrolidin-1-ylmethyl)-1,2,3,4-tetrahydroisoquinoline Traditional Name: acetic acid; 5-methoxy-1-(pyrrolidinomethyl)-1,2,3,4-tetrahydroisoquinoline Formula: C17H26N2O3 MolecularWeight: 306.39994

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)O.COC1=CC=CC2=C1CCNC2CN3CCCC3

Isomeric SMILES

CC(=O)O.COC1=CC=CC2=C1CCNC2CN3CCCC3

InChI

InChI=1S/C15H22N2O.C2H4O2/c1-18-15-6-4-5-12-13(15)7-8-16-14(12)11-17-9-2-3-10-17;1-2(3)4/h4-6,14,16H,2-3,7-11H2,1H3;1H3,(H,3,4)