N-(1,3-benzothiazol-2-ylmethyl)-N-methyl-2-(3-nitrophenoxy)ethanamine

Systemtic Name: N-(1,3-benzothiazol-2-ylmethyl)-N-methyl-2-(3-nitrophenoxy)ethanamine Openeye Name: N-(1,3-benzothiazol-2-ylmethyl)-N-methyl-2-(3-nitrophenoxy)ethanamine CAS Name: N-(1,3-benzothiazol-2-ylmethyl)-N-methyl-2-(3-nitrophenoxy)ethanamine IUPAC Name: N-(1,3-benzothiazol-2-ylmethyl)-N-methyl-2-(3-nitrophenoxy)ethanamine Traditional Name: 1,3-benzothiazol-2-ylmethyl-methyl-[2-(3-nitrophenoxy)ethyl]amine Formula: C17H17N3O3S MolecularWeight: 343.40018

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Descriptors Computed from Structure

Canonical SMILES:

CN(CCOC1=CC=CC(=C1)[N+](=O)[O-])CC2=NC3=CC=CC=C3S2

Isomeric SMILES

CN(CCOC1=CC=CC(=C1)[N+](=O)[O-])CC2=NC3=CC=CC=C3S2

InChI

InChI=1S/C17H17N3O3S/c1-19(12-17-18-15-7-2-3-8-16(15)24-17)9-10-23-14-6-4-5-13(11-14)20(21)22/h2-8,11H,9-10,12H2,1H3