(3R,6S)-N-(1,3-benzodioxol-5-ylmethyl)-6-[(3-methoxyquinolin-5-yl)oxymethyl]oxan-3-amine

Systemtic Name: (3R,6S)-N-(1,3-benzodioxol-5-ylmethyl)-6-[(3-methoxyquinolin-5-yl)oxymethyl]oxan-3-amine Openeye Name: (3R,6S)-N-(1,3-benzodioxol-5-ylmethyl)-6-[(3-methoxy-5-quinolyl)oxymethyl]tetrahydropyran-3-amine CAS Name: (3R,6S)-N-(1,3-benzodioxol-5-ylmethyl)-6-[(3-methoxy-5-quinolinyl)oxymethyl]-3-oxanamine IUPAC Name: (3R,6S)-N-(1,3-benzodioxol-5-ylmethyl)-6-[(3-methoxyquinolin-5-yl)oxymethyl]oxan-3-amine Traditional Name: [(3R,6S)-6-[(3-methoxy-5-quinolyl)oxymethyl]tetrahydropyran-3-yl]-piperonyl-amine Formula: C24H26N2O5 MolecularWeight: 422.47364

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CN=C2C=CC=C(C2=C1)OCC3CCC(CO3)NCC4=CC5=C(C=C4)OCO5

Isomeric SMILES

COC1=CN=C2C=CC=C(C2=C1)OC[C@@H]3CC[C@H](CO3)NCC4=CC5=C(C=C4)OCO5

InChI

InChI=1S/C24H26N2O5/c1-27-19-10-20-21(26-12-19)3-2-4-22(20)29-14-18-7-6-17(13-28-18)25-11-16-5-8-23-24(9-16)31-15-30-23/h2-5,8-10,12,17-18,25H,6-7,11,13-15H2,1H3/t17-,18+/m1/s1