4-bromanyl-N-[3-chloranyl-4-[4-(2,2-dimethylpropanoyl)piperazin-1-yl]phenyl]-3-methoxy-naphthalene-2-carboxamide

Systemtic Name: 4-bromanyl-N-[3-chloranyl-4-[4-(2,2-dimethylpropanoyl)piperazin-1-yl]phenyl]-3-methoxy-naphthalene-2-carboxamide Openeye Name: 4-bromo-N-[3-chloro-4-[4-(2,2-dimethylpropanoyl)piperazin-1-yl]phenyl]-3-methoxy-naphthalene-2-carboxamide CAS Name: 4-bromo-N-[3-chloro-4-[4-(2,2-dimethyl-1-oxopropyl)-1-piperazinyl]phenyl]-3-methoxy-2-naphthalenecarboxamide IUPAC Name: 4-bromo-N-[3-chloro-4-[4-(2,2-dimethylpropanoyl)piperazin-1-yl]phenyl]-3-methoxynaphthalene-2-carboxamide Traditional Name: 4-bromo-N-[3-chloro-4-(4-pivaloylpiperazino)phenyl]-3-methoxy-2-naphthamide Formula: C27H29BrClN3O3 MolecularWeight: 558.89446

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C(=O)N1CCN(CC1)C2=C(C=C(C=C2)NC(=O)C3=CC4=CC=CC=C4C(=C3OC)Br)Cl

Isomeric SMILES

CC(C)(C)C(=O)N1CCN(CC1)C2=C(C=C(C=C2)NC(=O)C3=CC4=CC=CC=C4C(=C3OC)Br)Cl

InChI

InChI=1S/C27H29BrClN3O3/c1-27(2,3)26(34)32-13-11-31(12-14-32)22-10-9-18(16-21(22)29)30-25(33)20-15-17-7-5-6-8-19(17)23(28)24(20)35-4/h5-10,15-16H,11-14H2,1-4H3,(H,30,33)