10-[4-(4-nitrophenyl)piperazin-1-yl]carbonyl-9,10-dihydroanthracene-9-carboxylic acid

Systemtic Name: 10-[4-(4-nitrophenyl)piperazin-1-yl]carbonyl-9,10-dihydroanthracene-9-carboxylic acid Openeye Name: 10-[4-(4-nitrophenyl)piperazine-1-carbonyl]-9,10-dihydroanthracene-9-carboxylic acid CAS Name: 10-[[4-(4-nitrophenyl)-1-piperazinyl]-oxomethyl]-9,10-dihydroanthracene-9-carboxylic acid IUPAC Name: 10-[4-(4-nitrophenyl)piperazine-1-carbonyl]-9,10-dihydroanthracene-9-carboxylic acid Traditional Name: 10-[4-(4-nitrophenyl)piperazine-1-carbonyl]-9,10-dihydroanthracene-9-carboxylic acid Formula: C26H23N3O5 MolecularWeight: 457.47792

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1C2=CC=C(C=C2)[N+](=O)[O-])C(=O)C3C4=CC=CC=C4C(C5=CC=CC=C35)C(=O)O

Isomeric SMILES

C1CN(CCN1C2=CC=C(C=C2)[N+](=O)[O-])C(=O)C3C4=CC=CC=C4C(C5=CC=CC=C35)C(=O)O

InChI

InChI=1S/C26H23N3O5/c30-25(28-15-13-27(14-16-28)17-9-11-18(12-10-17)29(33)34)23-19-5-1-3-7-21(19)24(26(31)32)22-8-4-2-6-20(22)23/h1-12,23-24H,13-16H2,(H,31,32)