(1R,2R)-N-[(2-methoxyphenyl)methyl]-2-nitro-1-thiophen-2-yl-butan-1-amine

Systemtic Name: (1R,2R)-N-[(2-methoxyphenyl)methyl]-2-nitro-1-thiophen-2-yl-butan-1-amine Openeye Name: (1R,2R)-N-[(2-methoxyphenyl)methyl]-2-nitro-1-(2-thienyl)butan-1-amine CAS Name: (1R,2R)-N-[(2-methoxyphenyl)methyl]-2-nitro-1-thiophen-2-yl-1-butanamine IUPAC Name: (1R,2R)-N-[(2-methoxyphenyl)methyl]-2-nitro-1-thiophen-2-ylbutan-1-amine Traditional Name: [(1R,2R)-2-nitro-1-(2-thienyl)butyl]-o-anisyl-amine Formula: C16H20N2O3S MolecularWeight: 320.4066

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C(C1=CC=CS1)NCC2=CC=CC=C2OC)[N+](=O)[O-]

Isomeric SMILES

CC[C@H]([C@H](C1=CC=CS1)NCC2=CC=CC=C2OC)[N+](=O)[O-]

InChI

InChI=1S/C16H20N2O3S/c1-3-13(18(19)20)16(15-9-6-10-22-15)17-11-12-7-4-5-8-14(12)21-2/h4-10,13,16-17H,3,11H2,1-2H3/t13-,16-/m1/s1