N-[3-chloranyl-4-(4-propanoylpiperazin-1-yl)phenyl]-4-(2-oxidanylidenechromen-3-yl)benzamide

Systemtic Name: N-[3-chloranyl-4-(4-propanoylpiperazin-1-yl)phenyl]-4-(2-oxidanylidenechromen-3-yl)benzamide Openeye Name: N-[3-chloro-4-(4-propanoylpiperazin-1-yl)phenyl]-4-(2-oxochromen-3-yl)benzamide CAS Name: N-[3-chloro-4-[4-(1-oxopropyl)-1-piperazinyl]phenyl]-4-(2-oxo-1-benzopyran-3-yl)benzamide IUPAC Name: N-[3-chloro-4-(4-propanoylpiperazin-1-yl)phenyl]-4-(2-oxochromen-3-yl)benzamide Traditional Name: N-[3-chloro-4-(4-propionylpiperazino)phenyl]-4-(2-ketochromen-3-yl)benzamide Formula: C29H26ClN3O4 MolecularWeight: 515.98744

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Descriptors Computed from Structure

Canonical SMILES:

CCC(=O)N1CCN(CC1)C2=C(C=C(C=C2)NC(=O)C3=CC=C(C=C3)C4=CC5=CC=CC=C5OC4=O)Cl

Isomeric SMILES

CCC(=O)N1CCN(CC1)C2=C(C=C(C=C2)NC(=O)C3=CC=C(C=C3)C4=CC5=CC=CC=C5OC4=O)Cl

InChI

InChI=1S/C29H26ClN3O4/c1-2-27(34)33-15-13-32(14-16-33)25-12-11-22(18-24(25)30)31-28(35)20-9-7-19(8-10-20)23-17-21-5-3-4-6-26(21)37-29(23)36/h3-12,17-18H,2,13-16H2,1H3,(H,31,35)