(2-methyl-1H-indol-3-yl)methylidene-[(2S)-2-(4-nitrophenyl)-2-oxidanyl-ethyl]azanium

Systemtic Name: (2-methyl-1H-indol-3-yl)methylidene-[(2S)-2-(4-nitrophenyl)-2-oxidanyl-ethyl]azanium Openeye Name: [(2S)-2-hydroxy-2-(4-nitrophenyl)ethyl]-[(2-methyl-1H-indol-3-yl)methylene]ammonium CAS Name: [(2S)-2-hydroxy-2-(4-nitrophenyl)ethyl]-[(2-methyl-1H-indol-3-yl)methylidene]ammonium IUPAC Name: [(2S)-2-hydroxy-2-(4-nitrophenyl)ethyl]-[(2-methyl-1H-indol-3-yl)methylidene]azanium Traditional Name: [(2S)-2-hydroxy-2-(4-nitrophenyl)ethyl]-[(2-methyl-1H-indol-3-yl)methylene]ammonium Formula: C18H18N3O3+ MolecularWeight: 324.35382

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C2=CC=CC=C2N1)C=[NH+]CC(C3=CC=C(C=C3)[N+](=O)[O-])O

Isomeric SMILES

CC1=C(C2=CC=CC=C2N1)C=[NH+]C[C@H](C3=CC=C(C=C3)[N+](=O)[O-])O

InChI

InChI=1S/C18H17N3O3/c1-12-16(15-4-2-3-5-17(15)20-12)10-19-11-18(22)13-6-8-14(9-7-13)21(23)24/h2-10,18,20,22H,11H2,1H3/p+1/t18-/m1/s1