2-[[(S)-(4-methoxyphenyl)-phenyl-methyl]amino]-5-nitro-benzenecarbonitrile

Systemtic Name: 2-[[(S)-(4-methoxyphenyl)-phenyl-methyl]amino]-5-nitro-benzenecarbonitrile Openeye Name: 2-[[(S)-(4-methoxyphenyl)-phenyl-methyl]amino]-5-nitro-benzonitrile CAS Name: 2-[[(S)-(4-methoxyphenyl)-phenylmethyl]amino]-5-nitrobenzonitrile IUPAC Name: 2-[[(S)-(4-methoxyphenyl)-phenylmethyl]amino]-5-nitrobenzonitrile Traditional Name: 2-[[(S)-(4-methoxyphenyl)-phenyl-methyl]amino]-5-nitro-benzonitrile Formula: C21H17N3O3 MolecularWeight: 359.37798

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)C(C2=CC=CC=C2)NC3=C(C=C(C=C3)[N+](=O)[O-])C#N

Isomeric SMILES

COC1=CC=C(C=C1)[C@H](C2=CC=CC=C2)NC3=C(C=C(C=C3)[N+](=O)[O-])C#N

InChI

InChI=1S/C21H17N3O3/c1-27-19-10-7-16(8-11-19)21(15-5-3-2-4-6-15)23-20-12-9-18(24(25)26)13-17(20)14-22/h2-13,21,23H,1H3/t21-/m0/s1