(S)-(3-chloranyl-5-nitro-phenyl)-(4-propan-2-ylphenyl)methanamine

Systemtic Name: (S)-(3-chloranyl-5-nitro-phenyl)-(4-propan-2-ylphenyl)methanamine Openeye Name: (S)-(3-chloro-5-nitro-phenyl)-(4-isopropylphenyl)methanamine CAS Name: (S)-(3-chloro-5-nitrophenyl)-(4-propan-2-ylphenyl)methanamine IUPAC Name: (S)-(3-chloro-5-nitrophenyl)-(4-propan-2-ylphenyl)methanamine Traditional Name: [(S)-(3-chloro-5-nitro-phenyl)-p-cumenyl-methyl]amine Formula: C16H17ClN2O2 MolecularWeight: 304.77138

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C1=CC=C(C=C1)C(C2=CC(=CC(=C2)Cl)[N+](=O)[O-])N

Isomeric SMILES

CC(C)C1=CC=C(C=C1)[C@@H](C2=CC(=CC(=C2)Cl)[N+](=O)[O-])N

InChI

InChI=1S/C16H17ClN2O2/c1-10(2)11-3-5-12(6-4-11)16(18)13-7-14(17)9-15(8-13)19(20)21/h3-10,16H,18H2,1-2H3/t16-/m0/s1