3-[1-(7-chloranyl-1,3-benzodioxol-5-yl)-2-nitro-ethyl]-2-methyl-1H-indole

Systemtic Name: 3-[1-(7-chloranyl-1,3-benzodioxol-5-yl)-2-nitro-ethyl]-2-methyl-1H-indole Openeye Name: 3-[1-(7-chloro-1,3-benzodioxol-5-yl)-2-nitro-ethyl]-2-methyl-1H-indole CAS Name: 3-[1-(7-chloro-1,3-benzodioxol-5-yl)-2-nitroethyl]-2-methyl-1H-indole IUPAC Name: 3-[1-(7-chloro-1,3-benzodioxol-5-yl)-2-nitroethyl]-2-methyl-1H-indole Traditional Name: 3-[1-(7-chloro-1,3-benzodioxol-5-yl)-2-nitro-ethyl]-2-methyl-1H-indole Formula: C18H15ClN2O4 MolecularWeight: 358.7757

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C2=CC=CC=C2N1)C(C[N+](=O)[O-])C3=CC4=C(C(=C3)Cl)OCO4

Isomeric SMILES

CC1=C(C2=CC=CC=C2N1)C(C[N+](=O)[O-])C3=CC4=C(C(=C3)Cl)OCO4

InChI

InChI=1S/C18H15ClN2O4/c1-10-17(12-4-2-3-5-15(12)20-10)13(8-21(22)23)11-6-14(19)18-16(7-11)24-9-25-18/h2-7,13,20H,8-9H2,1H3