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

Systemtic Name: N-[4-[4-(3-methylbutanoyl)piperazin-1-yl]phenyl]naphthalene-2-carboxamide Openeye Name: N-[4-[4-(3-methylbutanoyl)piperazin-1-yl]phenyl]naphthalene-2-carboxamide CAS Name: N-[4-[4-(3-methyl-1-oxobutyl)-1-piperazinyl]phenyl]-2-naphthalenecarboxamide IUPAC Name: N-[4-[4-(3-methylbutanoyl)piperazin-1-yl]phenyl]naphthalene-2-carboxamide Traditional Name: N-[4-(4-isovalerylpiperazino)phenyl]-2-naphthamide Formula: C26H29N3O2 MolecularWeight: 415.52736

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C26H29N3O2/c1-19(2)17-25(30)29-15-13-28(14-16-29)24-11-9-23(10-12-24)27-26(31)22-8-7-20-5-3-4-6-21(20)18-22/h3-12,18-19H,13-17H2,1-2H3,(H,27,31)