3-naphthalen-2-ylimino-1-[[4-(4-nitrophenyl)piperazin-1-ium-1-yl]methyl]indol-2-one

Systemtic Name: 3-naphthalen-2-ylimino-1-[[4-(4-nitrophenyl)piperazin-1-ium-1-yl]methyl]indol-2-one Openeye Name: 3-(2-naphthylimino)-1-[[4-(4-nitrophenyl)piperazin-1-ium-1-yl]methyl]indolin-2-one CAS Name: 3-(2-naphthalenylimino)-1-[[4-(4-nitrophenyl)-1-piperazin-1-iumyl]methyl]-2-indolone IUPAC Name: 3-naphthalen-2-ylimino-1-[[4-(4-nitrophenyl)piperazin-1-ium-1-yl]methyl]indol-2-one Traditional Name: 3-(2-naphthylimino)-1-[[4-(4-nitrophenyl)piperazin-1-ium-1-yl]methyl]oxindole Formula: C29H26N5O3+ MolecularWeight: 492.54844

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CC[NH+]1CN2C3=CC=CC=C3C(=NC4=CC5=CC=CC=C5C=C4)C2=O)C6=CC=C(C=C6)[N+](=O)[O-]

Isomeric SMILES

C1CN(CC[NH+]1CN2C3=CC=CC=C3C(=NC4=CC5=CC=CC=C5C=C4)C2=O)C6=CC=C(C=C6)[N+](=O)[O-]

InChI

InChI=1S/C29H25N5O3/c35-29-28(30-23-10-9-21-5-1-2-6-22(21)19-23)26-7-3-4-8-27(26)33(29)20-31-15-17-32(18-16-31)24-11-13-25(14-12-24)34(36)37/h1-14,19H,15-18,20H2/p+1