4-[[10-oxidanylidene-10-[(4-sulfonaphthalen-1-yl)amino]decanoyl]amino]naphthalene-1-sulfonic acid

Systemtic Name: 4-[[10-oxidanylidene-10-[(4-sulfonaphthalen-1-yl)amino]decanoyl]amino]naphthalene-1-sulfonic acid Openeye Name: 4-[[10-oxo-10-[(4-sulfo-1-naphthyl)amino]decanoyl]amino]naphthalene-1-sulfonic acid CAS Name: 4-[[1,10-dioxo-10-[(4-sulfo-1-naphthalenyl)amino]decyl]amino]-1-naphthalenesulfonic acid IUPAC Name: 4-[[10-oxo-10-[(4-sulfonaphthalen-1-yl)amino]decanoyl]amino]naphthalene-1-sulfonic acid Traditional Name: 4-[[10-keto-10-[(4-sulfo-1-naphthyl)amino]decanoyl]amino]naphthalene-1-sulfonic acid Formula: C30H32N2O8S2 MolecularWeight: 612.71368

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)C(=CC=C2S(=O)(=O)O)NC(=O)CCCCCCCCC(=O)NC3=CC=C(C4=CC=CC=C43)S(=O)(=O)O

Isomeric SMILES

C1=CC=C2C(=C1)C(=CC=C2S(=O)(=O)O)NC(=O)CCCCCCCCC(=O)NC3=CC=C(C4=CC=CC=C43)S(=O)(=O)O

InChI

InChI=1S/C30H32N2O8S2/c33-29(31-25-17-19-27(41(35,36)37)23-13-9-7-11-21(23)25)15-5-3-1-2-4-6-16-30(34)32-26-18-20-28(42(38,39)40)24-14-10-8-12-22(24)26/h7-14,17-20H,1-6,15-16H2,(H,31,33)(H,32,34)(H,35,36,37)(H,38,39,40)