2-[5-(1,3-benzodioxol-4-yl)-1,3-benzoxazol-2-yl]-N1-propyl-benzene-1,4-diamine

Systemtic Name: 2-[5-(1,3-benzodioxol-4-yl)-1,3-benzoxazol-2-yl]-N1-propyl-benzene-1,4-diamine Openeye Name: 2-[5-(1,3-benzodioxol-4-yl)-1,3-benzoxazol-2-yl]-N1-propyl-benzene-1,4-diamine CAS Name: 2-[5-(1,3-benzodioxol-4-yl)-1,3-benzoxazol-2-yl]-N1-propylbenzene-1,4-diamine IUPAC Name: 2-[5-(1,3-benzodioxol-4-yl)-1,3-benzoxazol-2-yl]-1-N-propylbenzene-1,4-diamine Traditional Name: [4-amino-2-[5-(1,3-benzodioxol-4-yl)-1,3-benzoxazol-2-yl]phenyl]-propyl-amine Formula: C23H21N3O3 MolecularWeight: 387.43114

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Descriptors Computed from Structure

Canonical SMILES:

CCCNC1=C(C=C(C=C1)N)C2=NC3=C(O2)C=CC(=C3)C4=C5C(=CC=C4)OCO5

Isomeric SMILES

CCCNC1=C(C=C(C=C1)N)C2=NC3=C(O2)C=CC(=C3)C4=C5C(=CC=C4)OCO5

InChI

InChI=1S/C23H21N3O3/c1-2-10-25-18-8-7-15(24)12-17(18)23-26-19-11-14(6-9-20(19)29-23)16-4-3-5-21-22(16)28-13-27-21/h3-9,11-12,25H,2,10,13,24H2,1H3