3-[(4-tert-butylphenyl)amino]-5-nitro-indol-2-one

Systemtic Name: 3-[(4-tert-butylphenyl)amino]-5-nitro-indol-2-one Openeye Name: 3-(4-tert-butylanilino)-5-nitro-indol-2-one CAS Name: 3-(4-tert-butylanilino)-5-nitro-2-indolone IUPAC Name: 3-(4-tert-butylanilino)-5-nitroindol-2-one Traditional Name: 3-(4-tert-butylanilino)-5-nitro-indol-2-one Formula: C18H17N3O3 MolecularWeight: 323.34588

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C1=CC=C(C=C1)NC2=C3C=C(C=CC3=NC2=O)[N+](=O)[O-]

Isomeric SMILES

CC(C)(C)C1=CC=C(C=C1)NC2=C3C=C(C=CC3=NC2=O)[N+](=O)[O-]

InChI

InChI=1S/C18H17N3O3/c1-18(2,3)11-4-6-12(7-5-11)19-16-14-10-13(21(23)24)8-9-15(14)20-17(16)22/h4-10H,1-3H3,(H,19,20,22)