9,10-bis(oxidanylidene)-N-[(2S)-3-oxidanyl-1-oxidanylidene-1-(quinolin-6-ylamino)propan-2-yl]anthracene-2-carboxamide

Systemtic Name: 9,10-bis(oxidanylidene)-N-[(2S)-3-oxidanyl-1-oxidanylidene-1-(quinolin-6-ylamino)propan-2-yl]anthracene-2-carboxamide Openeye Name: N-[(1S)-1-(hydroxymethyl)-2-oxo-2-(6-quinolylamino)ethyl]-9,10-dioxo-anthracene-2-carboxamide CAS Name: N-[(2S)-3-hydroxy-1-oxo-1-(6-quinolinylamino)propan-2-yl]-9,10-dioxo-2-anthracenecarboxamide IUPAC Name: N-[(2S)-3-hydroxy-1-oxo-1-(quinolin-6-ylamino)propan-2-yl]-9,10-dioxoanthracene-2-carboxamide Traditional Name: 9,10-diketo-N-[(1S)-2-keto-1-methylol-2-(6-quinolylamino)ethyl]anthracene-2-carboxamide Formula: C27H19N3O5 MolecularWeight: 465.45686

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)C(=O)C3=C(C2=O)C=C(C=C3)C(=O)NC(CO)C(=O)NC4=CC5=C(C=C4)N=CC=C5

Isomeric SMILES

C1=CC=C2C(=C1)C(=O)C3=C(C2=O)C=C(C=C3)C(=O)N[C@@H](CO)C(=O)NC4=CC5=C(C=C4)N=CC=C5

InChI

InChI=1S/C27H19N3O5/c31-14-23(27(35)29-17-8-10-22-15(12-17)4-3-11-28-22)30-26(34)16-7-9-20-21(13-16)25(33)19-6-2-1-5-18(19)24(20)32/h1-13,23,31H,14H2,(H,29,35)(H,30,34)/t23-/m0/s1