2-[5-(1,3-dioxolan-2-yl)thiophen-2-yl]-7-methoxy-2-propyl-3,4,5,6-tetrahydroazepine

Systemtic Name: 2-[5-(1,3-dioxolan-2-yl)thiophen-2-yl]-7-methoxy-2-propyl-3,4,5,6-tetrahydroazepine Openeye Name: 2-[5-(1,3-dioxolan-2-yl)-2-thienyl]-7-methoxy-2-propyl-3,4,5,6-tetrahydroazepine CAS Name: 2-[5-(1,3-dioxolan-2-yl)-2-thiophenyl]-7-methoxy-2-propyl-3,4,5,6-tetrahydroazepine IUPAC Name: 2-[5-(1,3-dioxolan-2-yl)thiophen-2-yl]-7-methoxy-2-propyl-3,4,5,6-tetrahydroazepine Traditional Name: 2-[5-(1,3-dioxolan-2-yl)-2-thienyl]-7-methoxy-2-propyl-3,4,5,6-tetrahydroazepine Formula: C17H25NO3S MolecularWeight: 323.4503

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Descriptors Computed from Structure

Canonical SMILES:

CCCC1(CCCCC(=N1)OC)C2=CC=C(S2)C3OCCO3

Isomeric SMILES

CCCC1(CCCCC(=N1)OC)C2=CC=C(S2)C3OCCO3

InChI

InChI=1S/C17H25NO3S/c1-3-9-17(10-5-4-6-15(18-17)19-2)14-8-7-13(22-14)16-20-11-12-21-16/h7-8,16H,3-6,9-12H2,1-2H3