N-[3-chloranyl-4-[4-(3-methylbutanoyl)piperazin-1-yl]phenyl]naphthalene-2-carboxamide

Systemtic Name: N-[3-chloranyl-4-[4-(3-methylbutanoyl)piperazin-1-yl]phenyl]naphthalene-2-carboxamide Openeye Name: N-[3-chloro-4-[4-(3-methylbutanoyl)piperazin-1-yl]phenyl]naphthalene-2-carboxamide CAS Name: N-[3-chloro-4-[4-(3-methyl-1-oxobutyl)-1-piperazinyl]phenyl]-2-naphthalenecarboxamide IUPAC Name: N-[3-chloro-4-[4-(3-methylbutanoyl)piperazin-1-yl]phenyl]naphthalene-2-carboxamide Traditional Name: N-[3-chloro-4-(4-isovalerylpiperazino)phenyl]-2-naphthamide Formula: C26H28ClN3O2 MolecularWeight: 449.97242

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CC(=O)N1CCN(CC1)C2=C(C=C(C=C2)NC(=O)C3=CC4=CC=CC=C4C=C3)Cl

Isomeric SMILES

CC(C)CC(=O)N1CCN(CC1)C2=C(C=C(C=C2)NC(=O)C3=CC4=CC=CC=C4C=C3)Cl

InChI

InChI=1S/C26H28ClN3O2/c1-18(2)15-25(31)30-13-11-29(12-14-30)24-10-9-22(17-23(24)27)28-26(32)21-8-7-19-5-3-4-6-20(19)16-21/h3-10,16-18H,11-15H2,1-2H3,(H,28,32)