(1R)-1-(6-chloranyl-1,3-benzodioxol-5-yl)-N-(phenylmethyl)but-3-en-1-amine

Systemtic Name: (1R)-1-(6-chloranyl-1,3-benzodioxol-5-yl)-N-(phenylmethyl)but-3-en-1-amine Openeye Name: (1R)-N-benzyl-1-(6-chloro-1,3-benzodioxol-5-yl)but-3-en-1-amine CAS Name: (1R)-1-(6-chloro-1,3-benzodioxol-5-yl)-N-(phenylmethyl)-3-buten-1-amine IUPAC Name: (1R)-N-benzyl-1-(6-chloro-1,3-benzodioxol-5-yl)but-3-en-1-amine Traditional Name: benzyl-[(1R)-1-(6-chloro-1,3-benzodioxol-5-yl)but-3-enyl]amine Formula: C18H18ClNO2 MolecularWeight: 315.79402

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Descriptors Computed from Structure

Canonical SMILES:

C=CCC(C1=CC2=C(C=C1Cl)OCO2)NCC3=CC=CC=C3

Isomeric SMILES

C=CC[C@H](C1=CC2=C(C=C1Cl)OCO2)NCC3=CC=CC=C3

InChI

InChI=1S/C18H18ClNO2/c1-2-6-16(20-11-13-7-4-3-5-8-13)14-9-17-18(10-15(14)19)22-12-21-17/h2-5,7-10,16,20H,1,6,11-12H2/t16-/m1/s1