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

Systemtic Name: N-[3-chloranyl-2-[4-(2-methylpropanoyl)piperazin-1-yl]phenyl]-4-(2-oxidanylidenechromen-3-yl)benzamide Openeye Name: N-[3-chloro-2-[4-(2-methylpropanoyl)piperazin-1-yl]phenyl]-4-(2-oxochromen-3-yl)benzamide CAS Name: N-[3-chloro-2-[4-(2-methyl-1-oxopropyl)-1-piperazinyl]phenyl]-4-(2-oxo-1-benzopyran-3-yl)benzamide IUPAC Name: N-[3-chloro-2-[4-(2-methylpropanoyl)piperazin-1-yl]phenyl]-4-(2-oxochromen-3-yl)benzamide Traditional Name: N-[3-chloro-2-(4-isobutyrylpiperazino)phenyl]-4-(2-ketochromen-3-yl)benzamide Formula: C30H28ClN3O4 MolecularWeight: 530.01402

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C(=O)N1CCN(CC1)C2=C(C=CC=C2Cl)NC(=O)C3=CC=C(C=C3)C4=CC5=CC=CC=C5OC4=O

Isomeric SMILES

CC(C)C(=O)N1CCN(CC1)C2=C(C=CC=C2Cl)NC(=O)C3=CC=C(C=C3)C4=CC5=CC=CC=C5OC4=O

InChI

InChI=1S/C30H28ClN3O4/c1-19(2)29(36)34-16-14-33(15-17-34)27-24(31)7-5-8-25(27)32-28(35)21-12-10-20(11-13-21)23-18-22-6-3-4-9-26(22)38-30(23)37/h3-13,18-19H,14-17H2,1-2H3,(H,32,35)