3-[(1S)-2-nitro-1-phenyl-ethyl]-1-prop-2-enyl-indole

Systemtic Name: 3-[(1S)-2-nitro-1-phenyl-ethyl]-1-prop-2-enyl-indole Openeye Name: 1-allyl-3-[(1S)-2-nitro-1-phenyl-ethyl]indole CAS Name: 3-[(1S)-2-nitro-1-phenylethyl]-1-prop-2-enylindole IUPAC Name: 3-[(1S)-2-nitro-1-phenylethyl]-1-prop-2-enylindole Traditional Name: 1-allyl-3-[(1S)-2-nitro-1-phenyl-ethyl]indole Formula: C19H18N2O2 MolecularWeight: 306.35842

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Descriptors Computed from Structure

Canonical SMILES:

C=CCN1C=C(C2=CC=CC=C21)C(C[N+](=O)[O-])C3=CC=CC=C3

Isomeric SMILES

C=CCN1C=C(C2=CC=CC=C21)[C@@H](C[N+](=O)[O-])C3=CC=CC=C3

InChI

InChI=1S/C19H18N2O2/c1-2-12-20-13-18(16-10-6-7-11-19(16)20)17(14-21(22)23)15-8-4-3-5-9-15/h2-11,13,17H,1,12,14H2/t17-/m0/s1