3-(azepan-1-ylmethyl)-4-(3,4-dimethoxyphenyl)-1,2-oxazol-5-amine

Systemtic Name: 3-(azepan-1-ylmethyl)-4-(3,4-dimethoxyphenyl)-1,2-oxazol-5-amine Openeye Name: 3-(azepan-1-ylmethyl)-4-(3,4-dimethoxyphenyl)isoxazol-5-amine CAS Name: 3-(1-azepanylmethyl)-4-(3,4-dimethoxyphenyl)-5-isoxazolamine IUPAC Name: 3-(azepan-1-ylmethyl)-4-(3,4-dimethoxyphenyl)-1,2-oxazol-5-amine Traditional Name: [3-(azepan-1-ylmethyl)-4-(3,4-dimethoxyphenyl)isoxazol-5-yl]amine Formula: C18H25N3O3 MolecularWeight: 331.4094

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)C2=C(ON=C2CN3CCCCCC3)N)OC

Isomeric SMILES

COC1=C(C=C(C=C1)C2=C(ON=C2CN3CCCCCC3)N)OC

InChI

InChI=1S/C18H25N3O3/c1-22-15-8-7-13(11-16(15)23-2)17-14(20-24-18(17)19)12-21-9-5-3-4-6-10-21/h7-8,11H,3-6,9-10,12,19H2,1-2H3