5-bromanyl-N-[3-chloranyl-4-[4-(4-propoxyphenyl)carbonylpiperazin-1-yl]phenyl]naphthalene-1-carboxamide

Systemtic Name: 5-bromanyl-N-[3-chloranyl-4-[4-(4-propoxyphenyl)carbonylpiperazin-1-yl]phenyl]naphthalene-1-carboxamide Openeye Name: 5-bromo-N-[3-chloro-4-[4-(4-propoxybenzoyl)piperazin-1-yl]phenyl]naphthalene-1-carboxamide CAS Name: 5-bromo-N-[3-chloro-4-[4-[oxo-(4-propoxyphenyl)methyl]-1-piperazinyl]phenyl]-1-naphthalenecarboxamide IUPAC Name: 5-bromo-N-[3-chloro-4-[4-(4-propoxybenzoyl)piperazin-1-yl]phenyl]naphthalene-1-carboxamide Traditional Name: 5-bromo-N-[3-chloro-4-[4-(4-propoxybenzoyl)piperazino]phenyl]-1-naphthamide Formula: C31H29BrClN3O3 MolecularWeight: 606.93726

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Descriptors Computed from Structure

Canonical SMILES:

CCCOC1=CC=C(C=C1)C(=O)N2CCN(CC2)C3=C(C=C(C=C3)NC(=O)C4=CC=CC5=C4C=CC=C5Br)Cl

Isomeric SMILES

CCCOC1=CC=C(C=C1)C(=O)N2CCN(CC2)C3=C(C=C(C=C3)NC(=O)C4=CC=CC5=C4C=CC=C5Br)Cl

InChI

InChI=1S/C31H29BrClN3O3/c1-2-19-39-23-12-9-21(10-13-23)31(38)36-17-15-35(16-18-36)29-14-11-22(20-28(29)33)34-30(37)26-7-3-6-25-24(26)5-4-8-27(25)32/h3-14,20H,2,15-19H2,1H3,(H,34,37)